N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-phenylprop-2-enamide
N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | V014-0688 |
| Compound Name: | N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-3-phenylprop-2-enamide |
| Molecular Weight: | 506.53 |
| Molecular Formula: | C28 H25 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2cccc(c2)C(F)(F)F)n(c2ccc(cc2)NC(/C=C/c2ccccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.5116 |
| logD: | 7.5116 |
| logSw: | -5.8095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.067 |
| InChI Key: | VMJZFMBKEILKNE-UHFFFAOYSA-N |