AC1M3NSC

2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl]sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide

Also Known As: F3394-0269|2-{[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide|2-((3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)thio)-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide|2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl]sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide|N-(3-phenyl-1,2,4-thiadiazol-5-yl)[3-cyano-4-(p-methoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinolylthio]acetamide

Molecular Formula	C29H25N5O3S2
Molecular Weight	555.1399 g/mol
LogP	6.03328
Topological Polar Surface Area	117.86 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	555.1399
Monoisotopic Mass	555.1399
Heavy Atoms	39
Complexity	1591.9048

Chemical Identifiers

CAS Number	670272-75-0
SMILES	CC1(CC2=C(C(=O)C1)C(=C(C(=N2)SCC(=O)NC3=NC(=NS3)C4=CC=CC=C4)C#N)C5=CC=C(C=C5)OC)C