2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G731-0428 |
| Compound Name: | 2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C17 H15 F N4 O S2 |
| Smiles: | CSc1cccc(c1)NC(CSc1nnc(c2ccc(cc2)F)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3507 |
| logD: | 2.159 |
| logSw: | -3.7172 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.623 |
| InChI Key: | VEXJPQBMQGNTLR-UHFFFAOYSA-N |