Category: 89-77-0

Ukrainets, Igor V.; Petrushova, Lidiya A.; Shishkina, Svitlana V.; Sidorenko, Lyudmila V.; Alekseeva, Tatiana V.; Torianyk, Inna I.; Davidenko, Alexandra A. published an article in 2020, the title of the article was Methyl4-hydroxy-2,2-dioxo-1H-2λ6,1-benzothiazine-3-carboxylate and its analogs modified in the benzene moiety of the molecule as new analgesics.Computed Properties of 89-77-0 And the article contains the following content:

In order to identify new regularities of the “structure-analgesic activity” relationship in the series of 2,1-benzothiazine derivatives, the synthesis of Me 4-hydroxy-2,2-dioxo-1H-2λ 6,1-benzothiazine-3-carboxylates I [R = H, 7-Cl, 6,8-di-Br, etc.] and a group of its analogs substituted in the benzene moiety of the mol., as well as their mono-and diammonium salts, was performed with tris(hydroxymethyl)aminomethane. The algorithm was proposed; it allowed for uniquely solving the question of the nature of the substituent and its true position in the benzothiazine core based on the complex use of NMR (1H and 13C) and mass spectrometry data. Using single-crystal X-ray diffraction anal. it was proven that salt formation first passed through the cyclic sulfamide group and only then through the 4-hydroxyl group and was always accompanied by a significant conformational rearrangement of the mol. Based on the results of pharmacol. tests it was found that modification of the benzene moiety of the mol. could be used as a method for enhancing the analgesic properties of the class of compounds studied. The presence of a substitute in position 7 was particularly effective, regardless of its nature. A comparative anal. of the analgesic activity of the initial esters and their mono- and diammonium salts convincingly showed that the common belief about a direct relationship between the solubility of a substance and the level of its biol. effect was not always true. As it turned out, increasing the solubility in water could lead to a variety of consequences: From a significant increase in analgesia to its complete elimination. It was suggested that the analgesic activity of the compounds studied was determined not by solubility, but by the mol. conformations formed during their obtainment. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Computed Properties of 89-77-0

The Article related to methyl hydroxy dioxo benzothiazine carboxylate preparation analgesic, Heterocyclic Compounds (More Than One Hetero Atom): Thiazines and other aspects.Computed Properties of 89-77-0

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Chen, Xiulei; Zhou, Zhen; Li, Zhong; Xu, Xiaoyong published an article in 2020, the title of the article was Synthesis and nematicidal activities of 1,2,3-benzotriazin-4-one containing 4,5-dihydrothiazole-2-thiol derivatives against Meloidogyne incognita.Synthetic Route of 89-77-0 And the article contains the following content:

A series of novel 1,2,3-benzotriazin-4-one derivatives containing 4,5-dihydrothiazole-2-thiol I (R = H, 5-OMe, 7-F, 8-NO2, etc.) was synthesized. The bioassay results showed that compounds I (R = 7-OMe, 6-NO2, 7-Cl (A)) exhibited good control efficacy against the cucumber root-knot nematode disease caused by Meloidogyne incognita at the concentration of 10.0 mg L-1 in vivo. Compound (A) showed excellent nematicidal activity with inhibition 68.3% at a concentration of 1.0 mg L-1. It suggested that the structure of 1,2,3-benzotriazin-4-one containing 4,5-dihydro-thiazole-2-thiol could be optimized further. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Synthetic Route of 89-77-0

The Article related to benzotriazinone dihydrothiazole thiol preparation nematocidal activity, Heterocyclic Compounds (More Than One Hetero Atom): Triazines and other aspects.Synthetic Route of 89-77-0

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Mohideen, Abbas Khaja; Mustaque, Kasim Mohammed; Meeran, Ismail Salim; Subramani, Annadurai; Ahamed, V. S. Jamal; Thajudeen, Habeebullah; Shabeer, Timiri Khudus published an article in 2022, the title of the article was Solvent-free synthesis, molecular simulation and cytotoxicity of 1,4-benzodiazepine-2,5-diones.SDS of cas: 89-77-0 And the article contains the following content:

The reaction of anthranilic acids with proline or pipecolic Me ester hydrochloride in presence of 1,1′-carbonyldiimidazole (CDI) on oil bath heating under solvent-free conditions afforded 1,4-benzodiazepine-2,5-dione (BZD) derivatives in moderate to good yields. Operational simplicity, absence of hazardous solvents, utility of an inexpensive coupling reagent (CDI) and mild reaction conditions are the significant advantages of this methodol. The cytotoxic activity of six BZDs were evaluated against HCT15 (Human Colon adenocarcinoma), SKMel2 (Human Skin Melanoma) and SKOV3 (Human Ovarian adenocarcinoma) cell lines. Compound I with p-Cl substitution showed moderate cytotoxicity against HCT15, SKMel2 and SKOV3 with IC50 values 37.04 +/- 1.13, 39.45 +/- 0.77 and 36.61 +/- 0.10μg/mL resp. The comprehensive anal. of the interaction between BZDs with receptor VEGFR-2 kinase, showed that compound I has higher mol. docking score with receptor. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).SDS of cas: 89-77-0

The Article related to benzodiazepine dione preparation green chem mol docking antitumor human, Heterocyclic Compounds (More Than One Hetero Atom): Diazepines and other aspects.SDS of cas: 89-77-0

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On January 17, 2021, Polina, Saibabu; Putta, V. P. Rama Kishore; Gujjarappa, Raghuram; Singh, Virender; Pujar, Prasad Pralhad; Malakar, Chandi C. published an article.Application of 89-77-0 The title of the article was P(III)-Mediated Cascade C-N/C-S Bond Formation: A Protocol Towards the Synthesis of N,S-Heterocycles and Spiro Compounds. And the article contained the following:

A P(III)-mediated entry towards construction of C-N/C-S bond has been devised. The developed heterocyclization method was applied to the synthesis of a diverse range of N,S-heterocycles and related spiro mols. P(NMe2)3 showed the maximum efficacies under the aerobic reaction conditions, and a range of bis-nucleophiles and isothiocyanates were tolerated well to serve the access of manifold immense mols. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Application of 89-77-0

The Article related to isothiocyanate amine heterocyclization phosphine mediated, thiazine benzothiazine thiazole preparation, spiro heterocycle preparation, Heterocyclic Compounds (More Than One Hetero Atom): Thiazines and other aspects.Application of 89-77-0

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Chlorides – an overview | ScienceDirect Topics

On January 31, 2022, Tatevosyan, Stepan S.; Kotovshchikov, Yury N.; Latyshev, Gennadij V.; Lukashev, Nikolay V.; Beletskaya, Irina P. published an article.Synthetic Route of 89-77-0 The title of the article was Facile Access to Triazole-Fused 3,1-Benzoxazines Enabled by Metal-Free Base-Promoted Intramolecular C-O Coupling. And the article contained the following:

A convenient approach to assemble 1,2,3-triazole-fused 4 H-3,1-benzoxazines I (R = H, 6-Me, 7-I, 7,8-dimethoxy, etc.; R1 = H, Me, Ph; R2 = Bu, cyclopropyl, Ph, etc.) has been developed. Diverse alc.-tethered 5-iodotriazoles II (R3 = H, 6-Me, 5-I, 4,5-dimethoxy, etc.), readily accessible by a modified protocol of Cu-catalyzed (3+2)-cycloaddition, were utilized as precursors of the target fused heterocycles I. The intramol. C-O coupling proceeded efficiently under base-mediated transition-metal-free conditions, furnishing cyclization products I in yields up to 96%. Suppression of the competing reductive cleavage of the C-I bond was achieved by the use of Na2CO3 in acetonitrile at 100°C. This practical and cost-effective procedure features a broad substrate scope and valuable functional group tolerance. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Synthetic Route of 89-77-0

The Article related to triazole benzoxazine preparation, iodotriazolyl benzyl alc preparation intramol coupling, Heterocyclic Compounds (More Than One Hetero Atom): Oxazines (Including Morpholine) and other aspects.Synthetic Route of 89-77-0

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On August 12, 2022, Wang, Tao; Chen, Xuling; Li, Pengfei published an article.Computed Properties of 89-77-0 The title of the article was One-Pot Divergent Synthesis of Benzoxazines and Dihydroquinolines from Morita-Baylis-Hillman Alcohols. And the article contained the following:

Benzoxazines and hydroquinolines was prepared by a one-pot process via catalyst-controlled divergent annulations of Morita-Baylis-Hillman (MBH) alcs. In the presence of diazabicyclo[2.2.2]octane, MBH alcs. reacted with Boc2O to form MBH carbonates, followed by intramol. annulation to give 4H-benzo[d][1,3]oxazines. Divergently, the combination of Bu4NBr and NaOH enabled the formation of 1,2-dihydroquinolines from the same starting materials. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Computed Properties of 89-77-0

The Article related to hydroxy carboxypropylene benzamide intramol heterocyclization, carboxyethylene benzoxazine preparation, acyl dihydroquinoline carboxylate preparation, Heterocyclic Compounds (More Than One Hetero Atom): Other 6-Membered Rings, Two Hetero Atoms and other aspects.Computed Properties of 89-77-0

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On June 10, 2021, Yao, Hong; Uras, Giuseppe; Zhang, Pengfei; Xu, Shengtao; Yin, Ying; Liu, Jie; Qin, Shuai; Li, Xinuo; Allen, Stephanie; Bai, Renren; Gong, Qi; Zhang, Haiyan; Zhu, Zheying; Xu, Jinyi published an article.Formula: C7H6ClNO2 The title of the article was Discovery of Novel Tacrine-Pyrimidone Hybrids as Potent Dual AChE/GSK-3 Inhibitors for the Treatment of Alzheimer’s Disease. And the article contained the following:

Based on a multitarget strategy, a series of novel tacrine-pyrimidone hybrids were identified for the potential treatment of Alzheimer’s disease (AD). Biol. evaluation results demonstrated that these hybrids exhibited significant inhibitory activities toward acetylcholinesterase (AChE) and glycogen synthase kinase 3 (GSK-3). The optimal compound 27g (I) possessed excellent dual AChE/GSK-3 inhibition both in terms of potency and equilibrium (AChE: IC50 = 51.1 nM; GSK-3β: IC50 = 89.3 nM) and displayed significant amelioration on cognitive deficits in scopolamine-induced amnesia mice and efficient reduction against phosphorylation of tau protein on Ser-199 and Ser-396 sites in glyceraldehyde (GA)-stimulated differentiated SH-SY5Y cells. Furthermore, compound 27g exhibited eligible pharmacokinetic properties, good kinase selectivity, and moderate neuroprotection against GA-induced reduction in cell viability and neurite damage in SH-SY5Y-derived neurons. The multifunctional profiles of compound 27g suggest that it deserves further investigation as a promising lead for the prospective treatment of AD. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Formula: C7H6ClNO2

The Article related to tacrine pyrimidone hybrid ache gsk3 inhibitor alzheimer disease, Pharmacology: Effects Of Nervous System- and Behavior-Affecting Drugs and Neuromuscular Agents and other aspects.Formula: C7H6ClNO2

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On July 29, 2022, Li, Xiang; Shen, Yang; Zhang, Guodong; Zheng, Xin; Zhao, Qing; Song, Zihe published an article.Name: 2-Amino-4-chlorobenzoic acid The title of the article was Ru(II)-Catalyzed Decarbonylative Alkylation and Annulations of Benzaldehydes with Iodonium Ylides under Chelation Assistance. And the article contained the following:

A Ru(II)-catalyzed decarbonylative alkylation and annulation of salicylaldehydes and 2-aminobenzaldehydes with iodonium ylides has been developed for the synthesis of dibenzo[b,d]furans and NH-free carbazolones. The reaction proceeds smoothly under mild conditions with a low catalyst loading and a broad substrate compatibility. Notably, hydroxy and free amino groups were demonstrated to be the effective directing groups, enabling the successful aldehyde C-H bond activation and subsequent decarbonylation and annulation under the inexpensive Ru(II) catalyst. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).Name: 2-Amino-4-chlorobenzoic acid

The Article related to dibenzofuran carbazolone preparation chelation, salicylaldehyde aminobenzaldehyde iodonium ylide decarbonylative alkylation annulation ruthenium catalyst, Heterocyclic Compounds (One Hetero Atom): Indoles, Indolizines, Carbazoles, and Other Arenopyrroles and other aspects.Name: 2-Amino-4-chlorobenzoic acid

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Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On February 15, 2020, Ding, Zichao; Ni, Tingjunhong; Xie, Fei; Hao, Yumeng; Yu, Shichong; Chai, Xiaoyun; Jin, Yongsheng; Wang, Ting; Jiang, Yuanying; Zhang, Dazhi published an article.SDS of cas: 89-77-0 The title of the article was Design, synthesis, and structure-activity relationship studies of novel triazole agents with strong antifungal activity against Aspergillus fumigatus. And the article contained the following:

The incidence of invasive fungal infections has dramatically increased for several decades. In order to discover novel antifungal agents with broad spectrum and anti-Aspergillus efficacy, a series of novel triazole derivatives containing 1,2,3-benzotriazin-4-one was designed and synthesized. Most of the compounds exhibited stronger in vitro antifungal activities against tested fungi than fluconazole. Moreover, 7-chloro-3-((2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl)benzo [d][1,2,3]triazin-4(3H)-one showed comparable antifungal activity against seven pathogenic strains as voriconazole and albaconazole, especially against Aspergillus fumigatus (MIC = 0.25μg/mL), and displayed moderate antifungal activity against fluconazole-resistant strains of Candida albicans. A clear SAR study indicated that compounds with groups at the 7-position resulted in novel antifungal triazoles with more effectiveness and a broader-spectrum. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).SDS of cas: 89-77-0

The Article related to triazole preparation sar antifungal agent aspergillus, antifungal, cyp51, molecular docking, synthesis, triazole, Heterocyclic Compounds (More Than One Hetero Atom): Other 5-Membered Rings, Two Or More Hetero Atoms and other aspects.SDS of cas: 89-77-0

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

On July 31, 2021, Wang, Kai; Wang, Binli; Liu, Xianghui; Fan, Hongjun; Liu, Yan; Li, Can published an article.SDS of cas: 89-77-0 The title of the article was Palladium-catalyzed enantioselective linear allylic alkylation of vinyl benzoxazinanones: An inner-sphere mechanism. And the article contained the following:

Palladium-catalyzed asym. allylic alkylation (AAA) of vinyl benzoxazinanones has become an important strategy for the synthesis of chiral nitrogen-containing heterocycle compounds However, the asym. synthesis of linear-selective products has rarely been reported. The simultaneous control of regio-, E/Z- and enantioselectivities constitutes a major challenge and inhibits the advancement of this chem. Herein, authors present a palladium-catalyzed AAA of vinyl benzoxazinanones with α-thiocyanato ketones, affording various chiral thiocyanates characterized with high linear-, E- and stereoselectivities. The reaction has a broad substrate scope and the chiral thiocyanates can be transformed to useful heterocycles. Exptl. and computational studies suggest an inner-sphere mechanism for AAA process, which results from the acidic and coordination effect of the nucleophilic substrates with palladium catalyst. The experimental process involved the reaction of 2-Amino-4-chlorobenzoic acid(cas: 89-77-0).SDS of cas: 89-77-0

The Article related to chiral thiocyanate preparation enantioselective computational study, vinyl benzoxazinanone thiocyanato ketone asym allylic alkylation palladium catalyst, Benzene, Its Derivatives, and Condensed Benzenoid Compounds: Nitriles, Isonitriles, and Acyl Cyanides and other aspects.SDS of cas: 89-77-0

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics