2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
Compound characteristics
| Compound ID: | D419-0192 |
| Compound Name: | 2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide |
| Molecular Weight: | 415.52 |
| Molecular Formula: | C23 H21 N5 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(Nc1cccc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7805 |
| logD: | 4.7804 |
| logSw: | -4.5649 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.851 |
| InChI Key: | CMQAUAQVDDZQMC-UHFFFAOYSA-N |