N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F019-0260 |
| Compound Name: | N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 497.45 |
| Molecular Formula: | C25 H22 Cl2 N4 O S |
| Smiles: | Cc1ccc(cc1)n1c(c2ccc(cc2)[Cl])nnc1SCC(Nc1c(C)cc(C)cc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.6611 |
| logD: | 6.6608 |
| logSw: | -6.3626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.466 |
| InChI Key: | IBRCJVPVXSDBBU-UHFFFAOYSA-N |