AC1NY8A7
6,6-dimethyl-9-(3-methylphenyl)-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one
Also Known As: BAS 11132673|6,6-dimethyl-9-(3-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|6,6-dimethyl-2-(methylthio)-9-(m-tolyl)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|6,6-DIMETHYL-9-(3-METHYLPHENYL)-2-(METHYLSULFANYL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE|6,6-dimethyl-9-(3-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol|6,6-dimethyl-9-(3-methylphenyl)-2-methylsulfanyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one|6,6-dimethyl-9-(3-methylphenyl)-2-methylthio-4,5,6,7,9,10-hexahydro-1,2,4-tria zolo[5,1-b]quinazolin-8-one
| Molecular Formula | C19H22N4OS |
|---|---|
| Molecular Weight | 354.15143 g/mol |
| LogP | 3.96652 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.15143 |
| Monoisotopic Mass | 354.15143 |
| Heavy Atoms | 25 |
| Complexity | 896.5791 |
Chemical Identifiers
| CAS Number | 727403-40-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2C3=C(CC(CC3=O)(C)C)NC4=NC(=NN24)SC |
Product Overview
AC1NY8A7 (CAS 727403-40-9), with molecular formula C19H22N4OS and molecular weight 354.15143 g/mol. IUPAC: 6,6-dimethyl-9-(3-methylphenyl)-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one.