Name: Name:1-[(pyridin-4-yl)methyl]-1H-indole-2-carboxylic acid
Brand: Angene
SKU: AG01B6K2
Rating: 90 (10 reviews)

1-[(pyridin-4-yl)methyl]-1H-indole-2-carboxylic acid

CAS No.:

1020968-56-2

Catalog Number:

AG01B6K2

Molecular Formula:

C15H12N2O2

Molecular Weight:

252.2680

Catalog Number:

AG01B6K2

Chemical Name:

1-[(pyridin-4-yl)methyl]-1H-indole-2-carboxylic acid

CAS Number:

1020968-56-2

Molecular Formula:

C15H12N2O2

Molecular Weight:

252.2680

MDL Number:

MFCD12626762

IUPAC Name:

1-(pyridin-4-ylmethyl)indole-2-carboxylic acid

InChI:

InChI=1S/C15H12N2O2/c18-15(19)14-9-12-3-1-2-4-13(12)17(14)10-11-5-7-16-8-6-11/h1-9H,10H2,(H,18,19)

InChI Key:

IYJTYOSXCYDMCJ-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc2c(n1Cc1ccncc1)cccc2

Complexity:

328

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.273g/mol

Monoisotopic Mass:

252.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5