2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G731-0355 |
| Compound Name: | 2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C17 H15 F N4 O2 S |
| Smiles: | COc1ccc(cc1)NC(CSc1nnc(c2ccc(cc2)F)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8722 |
| logD: | 1.6805 |
| logSw: | -3.5826 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.167 |
| InChI Key: | ABXKSMCRODELRS-UHFFFAOYSA-N |