2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | 8012-3404 |
| Compound Name: | 2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(propan-2-yl)phenyl]methyl}acetamide |
| Molecular Weight: | 460.57 |
| Molecular Formula: | C26 H25 F N4 O S |
| Smiles: | CC(C)c1ccc(CNC(CSc2nnc(c3cccc(c3)F)n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8065 |
| logD: | 5.8065 |
| logSw: | -5.5315 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.184 |
| InChI Key: | DTACYSZESQSRDI-UHFFFAOYSA-N |