N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enamide
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | K781-0785 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C20 H19 Cl N2 O4 |
| Smiles: | COc1ccc(\C=C(/C#N)C(NCc2cccc(c2)[Cl])=O)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.607 |
| logD: | 3.6068 |
| logSw: | -3.9524 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.772 |
| InChI Key: | WHQALEDTZHTKSA-UHFFFAOYSA-N |