AC1NY8AK

2-ethylsulfanyl-9-(3-hydroxyphenyl)-6,6-dimethyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Also Known As: NCGC00297773-01|BAS 11132728|AB01290768-01|2-(ethylsulfanyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|2-(ETHYLSULFANYL)-9-(3-HYDROXYPHENYL)-6,6-DIMETHYL-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE|2-(ethylsulfanyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol|2-(ethylthio)-9-(3-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|2-ethylsulfanyl-9-(3-hydroxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one|2-ethylthio-9-(3-hydroxyphenyl)-6,6-dimethyl-4,5,6,7,9,10-hexahydro-1,2,4-tria zolo[5,1-b]quinazolin-8-one

Molecular Formula	C19H22N4O2S
Molecular Weight	370.14636 g/mol
LogP	3.7538
Topological Polar Surface Area	80.04 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	370.14636
Monoisotopic Mass	370.14636
Heavy Atoms	26
Complexity	916.013

Chemical Identifiers

CAS Number	727403-87-4
SMILES	CCSC1=NN2C(C3=C(CC(CC3=O)(C)C)NC2=N1)C4=CC(=CC=C4)O