4-{[4-(3-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,2-diphenylethyl)butanamide
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,2-diphenylethyl)butanamide
4-{[4-(3-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,2-diphenylethyl)butanamide
Compound characteristics
| Compound ID: | P772-0053 |
| Compound Name: | 4-{[4-(3-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,2-diphenylethyl)butanamide |
| Molecular Weight: | 567.15 |
| Molecular Formula: | C33 H31 Cl N4 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1cccc(c1)[Cl])SCCCC(NC(Cc1ccccc1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.6429 |
| logD: | 7.6429 |
| logSw: | -6.3371 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.543 |
| InChI Key: | CGPSSPAUFFWVPL-PMERELPUSA-N |