6-[(2-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-[(2-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
6-[(2-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | C121-0492 |
| Compound Name: | 6-[(2-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 429.37 |
| Molecular Formula: | C21 H18 Cl2 N4 S |
| Smiles: | Cc1c(Cc2ccccc2[Cl])c(C)n2c(n1)nc(n2)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9961 |
| logD: | 5.996 |
| logSw: | -6.1695 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5549 |
| InChI Key: | CFROUWMFWKPNDO-UHFFFAOYSA-N |