3-{3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl}-2-cyano-N-(3-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
3-{3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl}-2-cyano-N-(3-methylphenyl)prop-2-enamide
3-{3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl}-2-cyano-N-(3-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 8009-2781 |
| Compound Name: | 3-{3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl}-2-cyano-N-(3-methylphenyl)prop-2-enamide |
| Molecular Weight: | 560.27 |
| Molecular Formula: | C26 H21 Br Cl2 N2 O3 |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2cccc(C)c2)=O)cc(c1OCc1ccc(cc1[Cl])[Cl])[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.5021 |
| logD: | 7.5013 |
| logSw: | -6.3927 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.997 |
| InChI Key: | CLQAKMHWMGGABT-UHFFFAOYSA-N |