N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F019-0387 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 448.97 |
| Molecular Formula: | C24 H21 Cl N4 O S |
| Smiles: | Cc1ccc(cc1)n1c(c2ccccc2)nnc1SCC(Nc1ccc(cc1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9666 |
| logD: | 5.9664 |
| logSw: | -6.069 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.164 |
| InChI Key: | UWGIKIIVTFAQSY-UHFFFAOYSA-N |