AC1NOQOV

2-[4-[(4-butoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid

Also Known As: 2-[4-(4-Butoxycarbonyl-phenylthiocarbamoyl)-piperazin-1-yl]-8-ethyl-5-oxo-5,8-dihydro-pyrido[2,3-d]pyri midine-6-carboxylic acid|2-[4-[(4-butoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid|2-(4-((4-(butoxycarbonyl)phenyl)carbamothioyl)piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid|2-(4-{[4-(BUTOXYCARBONYL)ANILINO]CARBOTHIOYL}PIPERAZINO)-8-ETHYL-5-OXO-5,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID|2-(4-{[4-(butoxycarbonyl)phenyl]carbamothioyl}piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid|2-[4-[(4-butoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylic acid|2-[4-[(4-butoxycarbonylphenyl)thiocarbamoyl]piperazino]-8-ethyl-5-keto-pyrido[2,3-d]pyrimidine-6-carboxylic acid|2-[4-[[4-[butoxy(oxo)methyl]anilino]-sulfanylidenemethyl]-1-piperazinyl]-8-ethyl-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylic acid

Molecular Formula	C26H30N6O5S
Molecular Weight	538.1998 g/mol
LogP	2.9855
Topological Polar Surface Area	129.89 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	538.1998
Monoisotopic Mass	538.1998
Heavy Atoms	38
Complexity	1399.7444

Chemical Identifiers

CAS Number	488746-07-2
SMILES	CCCCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NC=C4C(=O)C(=CN(C4=N3)CC)C(=O)O