N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-{4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl}prop-2-enamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-{4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl}prop-2-enamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-{4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl}prop-2-enamide
Compound characteristics
| Compound ID: | Y505-4815 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-{4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl}prop-2-enamide |
| Molecular Weight: | 504.87 |
| Molecular Formula: | C25 H17 Cl F4 N2 O3 |
| Smiles: | COc1cc(\C=C(/C#N)C(Nc2cc(ccc2[Cl])C(F)(F)F)=O)ccc1OCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 6.1398 |
| logD: | 4.3782 |
| logSw: | -6.3429 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.633 |
| InChI Key: | QVTQUBUKIGYADW-UHFFFAOYSA-N |