Name: Name:1-(2,5-dimethylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid
Brand: Angene
SKU: AG01B17W
Rating: 90 (10 reviews)

1-(2,5-dimethylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid

CAS No.:

1153985-53-5

Catalog Number:

AG01B17W

Molecular Formula:

C16H14N2O2

Molecular Weight:

266.2946

Catalog Number:

AG01B17W

Chemical Name:

1-(2,5-dimethylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid

CAS Number:

1153985-53-5

Molecular Formula:

C16H14N2O2

Molecular Weight:

266.2946

MDL Number:

MFCD13729598

IUPAC Name:

1-(2,5-dimethylphenyl)benzimidazole-5-carboxylic acid

InChI:

InChI=1S/C16H14N2O2/c1-10-3-4-11(2)15(7-10)18-9-17-13-8-12(16(19)20)5-6-14(13)18/h3-9H,1-2H3,(H,19,20)

InChI Key:

RDIBFASVCUAPMF-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)n1cnc2c1ccc(c2)C(=O)O)C

Complexity:

374

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.3g/mol

Monoisotopic Mass:

266.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4