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72418-92-9 | 1H-Benzimidazole-5-sulfonamide, 6-chloro-2-phenyl-
CAS No: 72418-92-9 Catalog No: AG005HL5 MDL No:
Product Description
Catalog Number:
AG005HL5
Chemical Name:
1H-Benzimidazole-5-sulfonamide, 6-chloro-2-phenyl-
CAS Number:
72418-92-9
Molecular Formula:
C13H10ClN3O2S
Molecular Weight:
307.7554
IUPAC Name:
6-chloro-2-phenyl-3H-benzimidazole-5-sulfonamide
InChI:
InChI=1S/C13H10ClN3O2S/c14-9-6-10-11(7-12(9)20(15,18)19)17-13(16-10)8-4-2-1-3-5-8/h1-7H,(H,16,17)(H2,15,18,19)
InChI Key:
NRZQLPCCBZGDAO-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]c(nc2cc1S(=O)(=O)N)c1ccccc1
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.018g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
307.752g/mol
Monoisotopic Mass:
307.018g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
97.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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