3-chloro-N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2,2-dimethylpropanamide
Chemical Structure Depiction of
3-chloro-N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2,2-dimethylpropanamide
3-chloro-N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | V011-5602 |
| Compound Name: | 3-chloro-N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2,2-dimethylpropanamide |
| Molecular Weight: | 466.89 |
| Molecular Formula: | C22 H22 Cl F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(C(C)(C)C[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1888 |
| logD: | 6.1888 |
| logSw: | -5.7943 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.176 |
| InChI Key: | LHMGAJSOTZEJRQ-UHFFFAOYSA-N |