AC1LYT1T

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

Also Known As: BAS 03154956|SR-01000505933-1|8-ethyl-2-(4-((4-fluorobenzoyl)carbamothioyl)piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid|8-ethyl-2-(4-{[(4-fluorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid|8-ETHYL-2-(4-{[(4-FLUOROPHENYL)FORMAMIDO]METHANETHIOYL}PIPERAZIN-1-YL)-5-OXO-5H,8H-PYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID|8-ethyl-2-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid

Molecular Formula	C22H21FN6O4S
Molecular Weight	484.1329 g/mol
LogP	1.4856
Topological Polar Surface Area	120.66 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	484.1329
Monoisotopic Mass	484.1329
Heavy Atoms	34
Complexity	1335.7145

Chemical Identifiers

CAS Number	370574-46-2
SMILES	CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=C(C=C4)F)C(=O)O