3-(4-{2-[2-(sec-butyl)phenoxy]ethoxy}-3-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-(4-{2-[2-(sec-butyl)phenoxy]ethoxy}-3-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-(4-{2-[2-(sec-butyl)phenoxy]ethoxy}-3-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0310 |
| Compound Name: | 3-(4-{2-[2-(sec-butyl)phenoxy]ethoxy}-3-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C27 H29 N3 O5 |
| Smiles: | CCC(C)c1ccccc1OCCOc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.88 |
| logD: | 4.36 |
| logSw: | -6.65 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 171.82 |
| InChI Key: | ODHIZDBJFIRHOA-SFHVURJKSA-N |