Name: Name:3-{[(pyridin-2-yl)methyl]amino}benzoic acid
Brand: Angene
SKU: AG01B6B5
Rating: 90 (10 reviews)

3-{[(pyridin-2-yl)methyl]amino}benzoic acid

CAS No.:

1094347-07-5

Catalog Number:

AG01B6B5

Molecular Formula:

C13H12N2O2

Molecular Weight:

228.2466

Catalog Number:

AG01B6B5

Chemical Name:

3-{[(pyridin-2-yl)methyl]amino}benzoic acid

CAS Number:

1094347-07-5

Molecular Formula:

C13H12N2O2

Molecular Weight:

228.2466

MDL Number:

MFCD11178919

IUPAC Name:

3-(pyridin-2-ylmethylamino)benzoic acid

InChI:

InChI=1S/C13H12N2O2/c16-13(17)10-4-3-6-11(8-10)15-9-12-5-1-2-7-14-12/h1-8,15H,9H2,(H,16,17)

InChI Key:

XOILKTOEBUSZDU-UHFFFAOYSA-N

SMILES:

OC(=O)c1cccc(c1)NCc1ccccn1

Complexity:

258

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.251g/mol

Monoisotopic Mass:

228.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9