2-cyano-3-{1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
Compound ID: | C482-0112 |
Compound Name: | 2-cyano-3-{1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
Molecular Weight: | 442.47 |
Molecular Formula: | C25 H22 N4 O4 |
Smiles: | Cc1cc(NC(C(=C/c2cn(CCOc3ccc(cc3)OC)c3ccccc23)\C#N)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.79 |
logD: | 2.85 |
logSw: | -5.47 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 167.9 |
InChI Key: | HDHOAIHAEZBTIB-UHFFFAOYSA-N |