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Home Sulfos Benzo[b]thiophene-3-sulfonamide

Benzo[b]thiophene-3-sulfonamide

CAS No.:
81885-35-0
Catalog Number:
AG00G8RT
Molecular Formula:
C8H7NO2S2
Molecular Weight:
213.2767
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Product Description
Catalog Number:
AG00G8RT
Chemical Name:
Benzo[b]thiophene-3-sulfonamide
CAS Number:
81885-35-0
Molecular Formula:
C8H7NO2S2
Molecular Weight:
213.2767
MDL Number:
MFCD06408799
IUPAC Name:
1-benzothiophene-3-sulfonamide
InChI:
InChI=1S/C8H7NO2S2/c9-13(10,11)8-5-12-7-4-2-1-3-6(7)8/h1-5H,(H2,9,10,11)
InChI Key:
BJVAENLIIOACPY-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1csc2c1cccc2
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.992g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.269g/mol
Monoisotopic Mass:
212.992g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
96.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
New benzo(b)thiophenesulphonamide 1,1-dioxide derivatives induce a reactive oxygen species-mediated process of apoptosis in tumour cells. Oncogene 20030612
New cytotoxic benzo(b)thiophenilsulfonamide 1,1-dioxide derivatives inhibit a NADH oxidase located in plasma membranes of tumour cells. British journal of cancer 20011101
Properties