N-(4-{3-[2-(4-methoxyphenyl)ethoxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(4-{3-[2-(4-methoxyphenyl)ethoxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-(trifluoromethyl)benzamide
N-(4-{3-[2-(4-methoxyphenyl)ethoxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V026-8282 |
| Compound Name: | N-(4-{3-[2-(4-methoxyphenyl)ethoxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 626.56 |
| Molecular Formula: | C32 H24 F6 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCOc2nc(c3cccc(c3)C(F)(F)F)n(c3ccc(cc3)NC(c3ccc(cc3)C(F)(F)F)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 8.2851 |
| logD: | 8.285 |
| logSw: | -5.8537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.471 |
| InChI Key: | NYBTVIJGTQJHFR-UHFFFAOYSA-N |