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2-(4-nitrophenyl)benzo[d]isothiazol-3(2H)-one is a chemical compound with the molecular formula C13H7N3O3S. It is a derivative of benzo[d]isothiazol-3(2H)-one, featuring a nitrophenyl group attached to the 2-position of the benzene ring. This yellow crystalline solid is commonly used as a chromogenic reagent in the detection of thiols, particularly in the Ellman's test, which is a widely employed method for determining the concentration of thiol-containing compounds such as glutathione. The compound is also known for its potential applications in the synthesis of pharmaceuticals and other organic compounds due to its unique structure and reactivity.

4322-98-9

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4322-98-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4322-98-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,3,2 and 2 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 4322-98:
(6*4)+(5*3)+(4*2)+(3*2)+(2*9)+(1*8)=79
79 % 10 = 9
So 4322-98-9 is a valid CAS Registry Number.

4322-98-9Relevant academic research and scientific papers

Facile synthesis and in vitro activity of n-substituted 1,2-benzisothiazol-3(2H)-ones against dengue virus NS2BNS3 protease

Batool, Farwa,Saeed, Muhammad,Saleem, Hafiza Nosheen,Kirschner, Luisa,Bodem, Jochen

, (2021/04/28)

Several new N-substituted 1,2-benzisothiazol-3(2H)-ones (BITs) were synthesised through a facile synthetic route for testing their anti-dengue protease inhibition. Contrary to the conventional multistep synthesis, we achieved structurally diverse BITs with excellent yields using a two-step, one-pot reaction strategy. All the synthesised compounds were prescreened for drug-like properties using the online Swiss Absorption, Distribution, Metabolism and Elimination (SwissADME) model, indicating their favourable pharmaceutical properties. Thus, the synthesised BITs were tested for inhibitory activity against the recombinant dengue virus serotype-2 (DENV-2) NS2BNS3 protease. Dose–response experiments and computational docking analyses revealed that several BITs bind to the protease in the vicinity of the catalytic triad with IC50 values in the micromolar range. The DENV2 infection assay showed that two BITs, 2-(2-chlorophenyl)benzo[d]isothiazol-3(2H)-one and 2-(2,6-dichlorophenyl)benzo[d]isothiazol-3(2H)-one, could suppress DENV replication and virus infectivity. These results indicate the potential of BITs for developing new anti-dengue therapeutics.

Co-Catalyzed Intramolecular S-N Bond Formation in Water for 1,2-Benzisothiazol-3(2H)-ones and 1,2,4-Thiadiazoles Synthesis

Yang, Liting,Song, Lijuan,Tang, Shanyu,Li, Longjia,Li, Heng,Yuan, Bingxin,Yang, Guanyu

, p. 1281 - 1285 (2019/01/14)

An efficient and versatile Co-catalyzed intramolecular S-N bond formation in water to synthesize 1,2-benzisothiazol-3(2H)-one and 1,2,4-thiadiazoles derivatives in good to excellent yields was developed. The transformation showed great tolerance with a broad range of substituents. The mother liquor was able to be recycled 6 times with minor loss in product yield.

Method for generating benzisothiazolinone compounds by catalyzing oxidization of molecular oxygen in aqueous phase

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Paragraph 0041-0044, (2019/01/16)

The invention provides a method for synthesizing benzisothiazolinone compounds by catalyzing oxidization of molecular oxygen in an aqueous phase. A water-soluble transition metal phthalocyanine compound is taken as a catalyst, and a thiosalicylic acid ami

An efficient approach to construct benzisothiazol-3(2: H)-ones via copper-catalyzed consecutive reaction of 2-halobenzamides and carbon disulfide

Li, Ting,Yang, Lei,Ni, Kaidong,Shi, Zhenyu,Li, Fei,Chen, Dongyin

, p. 6297 - 6303 (2016/07/11)

An efficient copper-catalyzed reaction for the synthesis of benzisothiazol-3(2H)-ones has been developed, starting from easily available 2-halobenzamides and carbon disulfide, which gave the corresponding target products in 30-89% yield for 25 examples. The reaction proceeds via a consecutive process with S-C bond and S-N bond formation.

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