AC1NXUEY

2-[(2-chlorophenyl)methylsulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro-4H-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Also Known As: Oprea1_202431|2-[(2-chlorobenzyl)sulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|2-((2-chlorobenzyl)thio)-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|2-[(2-chlorobenzyl)sulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol|2-[(2-chlorophenyl)methylsulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one|2-[(2-chlorophenyl)methylthio]-9-(3,4,5-trimethoxyphenyl)-4,5,6,7,9,10-hexahyd ro-1,2,4-triazolo[5,1-b]quinazolin-8-one|2-{[(2-CHLOROPHENYL)METHYL]SULFANYL}-9-(3,4,5-TRIMETHOXYPHENYL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE

Molecular Formula	C25H25ClN4O4S
Molecular Weight	512.1285 g/mol
LogP	5.2716
Topological Polar Surface Area	87.5 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	512.1285
Monoisotopic Mass	512.1285
Heavy Atoms	35
Complexity	1297.5408

Chemical Identifiers

CAS Number	536982-95-3
SMILES	COC1=CC(=CC(=C1OC)OC)C2C3=C(CCCC3=O)NC4=NC(=NN24)SCC5=CC=CC=C5Cl