N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide
Chemical Structure Depiction of
N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide
N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V001-4958 |
| Compound Name: | N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide |
| Molecular Weight: | 418.42 |
| Molecular Formula: | C21 H21 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(C(C)C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.369 |
| logD: | 5.369 |
| logSw: | -5.436 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.176 |
| InChI Key: | NRHGQOLNMWZQOY-UHFFFAOYSA-N |