3-{4-[(4-bromophenyl)methoxy]-3-ethoxyphenyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Chemical Structure Depiction of
3-{4-[(4-bromophenyl)methoxy]-3-ethoxyphenyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
3-{4-[(4-bromophenyl)methoxy]-3-ethoxyphenyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Compound characteristics
| Compound ID: | 8013-9474 |
| Compound Name: | 3-{4-[(4-bromophenyl)methoxy]-3-ethoxyphenyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide |
| Molecular Weight: | 579.8 |
| Molecular Formula: | C26 H19 Br Cl F3 N2 O3 |
| Smiles: | CCOc1cc(\C=C(/C#N)C(Nc2cc(ccc2[Cl])C(F)(F)F)=O)ccc1OCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.0902 |
| logD: | 5.3286 |
| logSw: | -6.5329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.213 |
| InChI Key: | PHSKIHUHWFILGY-UHFFFAOYSA-N |