N-(4-{5-(4-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-(4-{5-(4-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3,3-dimethylbutanamide
N-(4-{5-(4-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V025-4441 |
| Compound Name: | N-(4-{5-(4-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3,3-dimethylbutanamide |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C23 H27 F N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)Oc1nc(c2ccc(cc2)F)n(c2ccc(cc2)NC(CC(C)(C)C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7243 |
| logD: | 5.7243 |
| logSw: | -5.4545 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.642 |
| InChI Key: | VWDSQNIYCSSOQG-UHFFFAOYSA-N |