2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)propanamide
Chemical Structure Depiction of
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)propanamide
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)propanamide
Compound characteristics
| Compound ID: | 8012-3396 |
| Compound Name: | 2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)propanamide |
| Molecular Weight: | 460.57 |
| Molecular Formula: | C26 H25 F N4 O S |
| Smiles: | CC(C(Nc1c(C)cc(C)cc1C)=O)Sc1nnc(c2cccc(c2)F)n1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9229 |
| logD: | 5.9229 |
| logSw: | -5.5172 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.68 |
| InChI Key: | KFDMPMZLNZOTCI-IBGZPJMESA-N |