2-cyano-3-(3,4-diethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(3,4-diethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-(3,4-diethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-1000 |
| Compound Name: | 2-cyano-3-(3,4-diethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 341.36 |
| Molecular Formula: | C18 H19 N3 O4 |
| Smiles: | CCOc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.18 |
| logD: | 1.66 |
| logSw: | -3.94 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 160.58 |
| InChI Key: | QDFCYOZFROUEGW-UHFFFAOYSA-N |