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76989-93-0 | 1H-Benzimidazole-1-carboxamide, N-(2-chlorophenyl)-
CAS No: 76989-93-0 Catalog No: AG00579Q MDL No:
Product Description
Catalog Number:
AG00579Q
Chemical Name:
1H-Benzimidazole-1-carboxamide, N-(2-chlorophenyl)-
CAS Number:
76989-93-0
Molecular Formula:
C14H10ClN3O
Molecular Weight:
271.7017
IUPAC Name:
N-(2-chlorophenyl)benzimidazole-1-carboxamide
InChI:
InChI=1S/C14H10ClN3O/c15-10-5-1-2-6-11(10)17-14(19)18-9-16-12-7-3-4-8-13(12)18/h1-9H,(H,17,19)
InChI Key:
WGNMSARLFNGKRL-UHFFFAOYSA-N
SMILES:
Clc1ccccc1NC(=O)n1cnc2c1cccc2
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.704g/mol
Monoisotopic Mass:
271.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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