C13H12N6O2S structure

C13H12N6O2S

methyl 4-cyano-5-[(4,6-diamino-2-pyridinyl)diazenyl]-3-methylthiophene-2-carboxylate

Also Known As: 2-Thiophenecarboxylic acid, 4-cyano-5-[(4,6-diamino-2-pyridinyl)azo]-3-methyl-, methyl ester|2-((2,4-Diaminopyridin-6-yl)azo)-3-cyano-4-methyl-5-(methoxycarbonyl)thiophene|2-Thiophenecarboxylic acid, 4-cyano-5-((4,6-diamino-2-pyridinyl)azo)-3-methyl-, methyl ester|2-Thiophenecarboxylic acid, 4-cyano-5-(2-(4,6-diamino-2-pyridinyl)diazenyl)-3-methyl-, methyl ester

CAS: 72121-80-3
Molecular Formula C13H12N6O2S
Molecular Weight 316.07425 g/mol
LogP 2.6896
Topological Polar Surface Area 139.74 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 9
Rotatable Bonds 3
Exact Mass 316.07425
Monoisotopic Mass 316.07425
Heavy Atoms 22
Complexity 785.34216

Chemical Identifiers

CAS Number 72121-80-3
SMILES CC1=C(SC(=C1C#N)N=NC2=CC(=CC(=N2)N)N)C(=O)OC

Product Overview

C13H12N6O2S (CAS 72121-80-3), with molecular formula C13H12N6O2S and molecular weight 316.07425 g/mol. IUPAC: methyl 4-cyano-5-[(4,6-diamino-2-pyridinyl)diazenyl]-3-methylthiophene-2-carboxylate.

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