N-(2H-1,3-benzodioxol-5-yl)-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
N-(2H-1,3-benzodioxol-5-yl)-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 3453-1686 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-cyano-3-(4-methoxyphenyl)prop-2-enamide |
| Molecular Weight: | 322.32 |
| Molecular Formula: | C18 H14 N2 O4 |
| Smiles: | COc1ccc(\C=C(/C#N)C(Nc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3635 |
| logD: | 3.3389 |
| logSw: | -3.5662 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.045 |
| InChI Key: | YUTVJDXNPGWLNH-UHFFFAOYSA-N |