2-cyano-3-{3,5-dimethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3,5-dimethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{3,5-dimethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
Compound ID: | C482-0550 |
Compound Name: | 2-cyano-3-{3,5-dimethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
Molecular Weight: | 479.49 |
Molecular Formula: | C25 H25 N3 O7 |
Smiles: | Cc1cc(NC(C(=C/c2cc(c(c(c2)OC)OCCOc2ccccc2OC)OC)\C#N)=O)no1 |
Stereo: | ACHIRAL |
logP: | 3.88 |
logD: | 2.36 |
logSw: | -4.8 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 191.64 |
InChI Key: | AZBCVMXDHCAJFA-UHFFFAOYSA-N |