3-{3-chloro-5-ethoxy-4-[3-(2-methoxyphenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{3-chloro-5-ethoxy-4-[3-(2-methoxyphenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{3-chloro-5-ethoxy-4-[3-(2-methoxyphenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0537 |
| Compound Name: | 3-{3-chloro-5-ethoxy-4-[3-(2-methoxyphenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 511.96 |
| Molecular Formula: | C26 H26 Cl N3 O6 |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc(c1OCCCOc1ccccc1OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.54 |
| logD: | 4.03 |
| logSw: | -6.6 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 165.04 |
| InChI Key: | AQAVSCNMBVPMEE-UHFFFAOYSA-N |