N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide
Chemical Structure Depiction of
N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide
N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide
Compound characteristics
| Compound ID: | V004-3031 |
| Compound Name: | N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide |
| Molecular Weight: | 466.46 |
| Molecular Formula: | C25 H21 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(cc2)C(F)(F)F)n(c2cccc(c2)NC(c2ccc(C)cc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.6832 |
| logD: | 6.6832 |
| logSw: | -5.6211 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.905 |
| InChI Key: | OTCSMUKBLZSUHO-UHFFFAOYSA-N |