N-[(2-fluorophenyl)methyl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2-fluorophenyl)methyl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[(2-fluorophenyl)methyl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D489-0990 |
| Compound Name: | N-[(2-fluorophenyl)methyl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C24 H21 F N4 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(NCc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1451 |
| logD: | 5.1451 |
| logSw: | -5.0139 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.184 |
| InChI Key: | PLNWAKLMYZDPNC-UHFFFAOYSA-N |