Name: Name:2-Thiophenecarboxylic acid, 5-[[(5-chloro-2-Methyl-3-pyridinyl)aMino]Methyl]-
Brand: Angene
SKU: AG009C7M
Rating: 90 (10 reviews)

2-Thiophenecarboxylic acid, 5-[[(5-chloro-2-Methyl-3-pyridinyl)aMino]Methyl]-

CAS No.:

1404456-63-8

Catalog Number:

AG009C7M

Molecular Formula:

C12H11ClN2O2S

Molecular Weight:

282.7459

Catalog Number:

AG009C7M

Chemical Name:

2-Thiophenecarboxylic acid, 5-[[(5-chloro-2-Methyl-3-pyridinyl)aMino]Methyl]-

CAS Number:

1404456-63-8

Molecular Formula:

C12H11ClN2O2S

Molecular Weight:

282.7459

IUPAC Name:

5-[[(5-chloro-2-methylpyridin-3-yl)amino]methyl]thiophene-2-carboxylic acid

InChI:

InChI=1S/C12H11ClN2O2S/c1-7-10(4-8(13)5-14-7)15-6-9-2-3-11(18-9)12(16)17/h2-5,15H,6H2,1H3,(H,16,17)

InChI Key:

JNWKYGDFHVZHGQ-UHFFFAOYSA-N

SMILES:

Clc1cnc(c(c1)NCc1ccc(s1)C(=O)O)C

Complexity:

306

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.742g/mol

Monoisotopic Mass:

282.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9