N-(4-{3-methoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(4-{3-methoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
N-(4-{3-methoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V009-9242 |
| Compound Name: | N-(4-{3-methoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide |
| Molecular Weight: | 418.42 |
| Molecular Formula: | C21 H21 F3 N4 O2 |
| Smiles: | CC(C)CC(Nc1ccc(cc1)n1c(c2cccc(c2)C(F)(F)F)nc(n1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3119 |
| logD: | 5.3119 |
| logSw: | -5.4566 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.383 |
| InChI Key: | FXXCTCOTEVISMI-UHFFFAOYSA-N |