2-cyano-3-{3-ethoxy-4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-ethoxy-4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{3-ethoxy-4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
Compound ID: | C482-0503 |
Compound Name: | 2-cyano-3-{3-ethoxy-4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
Molecular Weight: | 477.52 |
Molecular Formula: | C26 H27 N3 O6 |
Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2cc(C)on2)=O)ccc1OCCCOc1cccc(c1)OC |
Stereo: | ACHIRAL |
logP: | 4.88 |
logD: | 3.36 |
logSw: | -5.86 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 184.28 |
InChI Key: | RIHGMEMPMYMMQF-UHFFFAOYSA-N |