Name: Name:2-(2-Pyridinyl)-1H-benzimidazole-5-carboxylic acid
Brand: Angene
SKU: AG00FFDW
Rating: 90 (10 reviews)

2-(2-Pyridinyl)-1H-benzimidazole-5-carboxylic acid

CAS No.:

669070-64-8

Catalog Number:

AG00FFDW

Molecular Formula:

C13H9N3O2

Molecular Weight:

239.2295

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Product Description

Catalog Number:

AG00FFDW

Chemical Name:

2-(2-Pyridinyl)-1H-benzimidazole-5-carboxylic acid

CAS Number:

669070-64-8

Molecular Formula:

C13H9N3O2

Molecular Weight:

239.2295

MDL Number:

MFCD06245483

IUPAC Name:

2-pyridin-2-yl-3H-benzimidazole-5-carboxylic acid

InChI:

InChI=1S/C13H9N3O2/c17-13(18)8-4-5-9-11(7-8)16-12(15-9)10-3-1-2-6-14-10/h1-7H,(H,15,16)(H,17,18)

InChI Key:

HCHZJVIOJPDFKA-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)[nH]c(n2)c1ccccn1

Properties

Complexity:

323

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.234g/mol

Monoisotopic Mass:

239.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Non-nucleoside inhibitors of the hepatitis C virus NS5B polymerase: discovery and preliminary SAR of benzimidazole derivatives.	Bioorganic & medicinal chemistry letters 20040105

Properties