3-{5-bromo-2-[(prop-2-en-1-yl)oxy]phenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide
Chemical Structure Depiction of
3-{5-bromo-2-[(prop-2-en-1-yl)oxy]phenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide
3-{5-bromo-2-[(prop-2-en-1-yl)oxy]phenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide
Compound characteristics
| Compound ID: | 8013-8274 |
| Compound Name: | 3-{5-bromo-2-[(prop-2-en-1-yl)oxy]phenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide |
| Molecular Weight: | 451.24 |
| Molecular Formula: | C20 H14 Br F3 N2 O2 |
| Smiles: | C=CCOc1ccc(cc1\C=C(/C#N)C(Nc1ccccc1C(F)(F)F)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.9057 |
| logD: | 5.9046 |
| logSw: | -5.9234 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.192 |
| InChI Key: | JTNLPIGYMSOYBG-UHFFFAOYSA-N |