5-{[(2-chlorophenyl)methyl]sulfanyl}-8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]sulfanyl}-8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
5-{[(2-chlorophenyl)methyl]sulfanyl}-8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | C445-0079 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]sulfanyl}-8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 462.96 |
| Molecular Formula: | C24 H19 Cl N4 O2 S |
| Smiles: | COc1cc2c(cc1OC)nc(n1c2nc(c2ccccc2)n1)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9803 |
| logD: | 5.9628 |
| logSw: | -6.1528 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.058 |
| InChI Key: | ZEYBATYYXMSEOR-UHFFFAOYSA-N |