N-(4-butoxyphenyl)-2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-butoxyphenyl)-2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-butoxyphenyl)-2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8012-3410 |
| Compound Name: | N-(4-butoxyphenyl)-2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C26 H25 F N4 O2 S |
| Smiles: | CCCCOc1ccc(cc1)NC(CSc1nnc(c2cccc(c2)F)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2193 |
| logD: | 6.2193 |
| logSw: | -5.3389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.28 |
| InChI Key: | GDHDESULDAHWHR-UHFFFAOYSA-N |