methyl 2-(2-cyano-3-{3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-cyano-3-{3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enamido)benzoate
methyl 2-(2-cyano-3-{3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enamido)benzoate
Compound characteristics
| Compound ID: | 8013-9667 |
| Compound Name: | methyl 2-(2-cyano-3-{3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enamido)benzoate |
| Molecular Weight: | 470.52 |
| Molecular Formula: | C28 H26 N2 O5 |
| Smiles: | CCOc1cc(\C=C(/C#N)C(Nc2ccccc2C(=O)OC)=O)ccc1OCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1793 |
| logD: | 3.7914 |
| logSw: | -5.0577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.386 |
| InChI Key: | AJLARMMTOLJELC-UHFFFAOYSA-N |