2-(benzylsulfanyl)-6-phenyl-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-6-phenyl-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
2-(benzylsulfanyl)-6-phenyl-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | D718-0121 |
| Compound Name: | 2-(benzylsulfanyl)-6-phenyl-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C22 H18 N4 O S |
| Smiles: | C1C(CC(C2=Cn3c(N=C12)nc(n3)SCc1ccccc1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8962 |
| logD: | 3.8962 |
| logSw: | -4.1136 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.121 |
| InChI Key: | AVGQLRYLGXPBND-QGZVFWFLSA-N |