N-(2-fluorophenyl)-2-{[5-(5-methyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-{[5-(5-methyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2-fluorophenyl)-2-{[5-(5-methyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8017-3950 |
| Compound Name: | N-(2-fluorophenyl)-2-{[5-(5-methyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C20 H17 F N6 O S |
| Smiles: | Cc1cc(c2nnc(n2c2ccccc2)SCC(Nc2ccccc2F)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.2268 |
| logD: | 3.2267 |
| logSw: | -3.4898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.732 |
| InChI Key: | SLSMZECTOFRMER-UHFFFAOYSA-N |