2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{2-[(propan-2-yl)oxy]phenyl}acetamide
Chemical Structure Depiction of
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{2-[(propan-2-yl)oxy]phenyl}acetamide
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{2-[(propan-2-yl)oxy]phenyl}acetamide
Compound characteristics
| Compound ID: | 8012-3400 |
| Compound Name: | 2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{2-[(propan-2-yl)oxy]phenyl}acetamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C25 H23 F N4 O2 S |
| Smiles: | CC(C)Oc1ccccc1NC(CSc1nnc(c2cccc(c2)F)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2979 |
| logD: | 5.2979 |
| logSw: | -5.2821 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.053 |
| InChI Key: | JAQMSMDTSRTYAG-UHFFFAOYSA-N |