N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C121-0130 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 466 |
| Molecular Formula: | C24 H24 Cl N5 O S |
| Smiles: | Cc1cccc(Cc2c(C)nc3nc(nn3c2C)SCC(NCc2ccccc2[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2026 |
| logD: | 5.2025 |
| logSw: | -5.6396 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.026 |
| InChI Key: | BOUAFYJXUGZKGS-UHFFFAOYSA-N |