N-(2,5-difluorophenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2,5-difluorophenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D489-1018 |
| Compound Name: | N-(2,5-difluorophenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 436.48 |
| Molecular Formula: | C23 H18 F2 N4 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(Nc1cc(ccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2567 |
| logD: | 5.2486 |
| logSw: | -5.0362 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.164 |
| InChI Key: | YGNKZXOAQRWUKZ-UHFFFAOYSA-N |