2-cyano-3-(3-ethoxy-4-hydroxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(3-ethoxy-4-hydroxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-(3-ethoxy-4-hydroxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0162 |
| Compound Name: | 2-cyano-3-(3-ethoxy-4-hydroxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 313.31 |
| Molecular Formula: | C16 H15 N3 O4 |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2cc(C)on2)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 2.79 |
| logD: | 1.27 |
| logSw: | -3.72 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 197.29 |
| InChI Key: | SKWOECVOBSIQKA-UHFFFAOYSA-N |