6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one

Modify Date: 2025-09-06 17:22:05

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure
6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one structure
Common Name 6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one
CAS Number 35452-55-2 Molecular Weight 244.10800
Density N/A Boiling Point N/A
Molecular Formula C8H6BrNOS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C8H6BrNOS
Molecular Weight 244.10800
Exact Mass 242.93500
PSA 50.24000
LogP 2.36250
InChIKey GOWQOGQMHZNPFN-UHFFFAOYSA-N
SMILES Cn1c(=O)sc2cc(Br)ccc21

 Safety Information

HS Code 2934200090

 Synthetic Route

~%

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

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Literature: NOVARTIS AG; ADAMS, Christopher Michael; CHAMOIN, Sylvie; HU, Qi-Ying; ZHANG, Chun Patent: WO2010/130794 A1, 2010 ; Location in patent: Page/Page column 110 ; WO 2010/130794 A1

~54%

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

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Literature: Yang, Yuan; Zhang, Xiaoyun; Zeng, Weilan; Huang, Hui; Liang, Yun RSC Advances, 2014 , vol. 4, # 12 p. 6090 - 6093

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6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

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Literature: Mellor, Michael; Osbourn, Susan E. Tetrahedron, 1991 , vol. 47, # 12-13 p. 2255 - 2262

~%

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

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Literature: Carato; Moussavi; Yous; Poupaert; Lebegue; Berthelot Synthetic Communications, 2004 , vol. 34, # 14 p. 2601 - 2609

~15%

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

Learn More
Literature: Mellor, Michael; Osbourn, Susan E. Tetrahedron, 1991 , vol. 47, # 12-13 p. 2255 - 2262

~84%

6-Bromo-3-methyl-1,3-benzothiazol-2(3H)-one Structure

6-Bromo-3-methy...

CAS#:35452-55-2

Learn More
Literature: Mellor, Michael; Osbourn, Susan E. Tetrahedron, 1991 , vol. 47, # 12-13 p. 2255 - 2262

 Customs

HS Code 2934200090
Summary 2934200090. other compounds containing in the structure a benzothiazole ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Bioassay

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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

6-bromo-3-methylindazole
3-Methyl-6-brom-indazol
1H-Indazole,6-broMo-3-Methyl
6-Bromo-3-methyl-2(3H)-benzothiazolone
6-bromo-3-methyl-3H-benzothiazol-2-one
6-bromo-3-methyl-1(2)H-indazole
3-Methyl-6-brom-benzthiazolin-2-on
3-Methyl-6-bromo-1H-indazole
6-Brom-3-methyl-3H-benzothiazol-2-on
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