N-(3-{3-[(propan-2-yl)oxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
Chemical Structure Depiction of
N-(3-{3-[(propan-2-yl)oxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
N-(3-{3-[(propan-2-yl)oxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
Compound characteristics
| Compound ID: | V017-5902 |
| Compound Name: | N-(3-{3-[(propan-2-yl)oxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide |
| Molecular Weight: | 418.42 |
| Molecular Formula: | C21 H21 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCC(Nc1cccc(c1)n1c(c2ccc(cc2)C(F)(F)F)nc(n1)OC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.445 |
| logD: | 5.445 |
| logSw: | -5.4036 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.642 |
| InChI Key: | WYYYIQJKOBCVHY-UHFFFAOYSA-N |