2-cyano-3-{3-ethoxy-4-[3-(2-methylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-ethoxy-4-[3-(2-methylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{3-ethoxy-4-[3-(2-methylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0502 |
| Compound Name: | 2-cyano-3-{3-ethoxy-4-[3-(2-methylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H27 N3 O5 |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2cc(C)on2)=O)ccc1OCCCOc1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.24 |
| logD: | 3.72 |
| logSw: | -5.94 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 160.47 |
| InChI Key: | TYVHZXOHFFWENF-UHFFFAOYSA-N |