3-{3-allyl-4-[2-(2-ethylphenoxy)ethoxy]-5-methoxyphenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{3-allyl-4-[2-(2-ethylphenoxy)ethoxy]-5-methoxyphenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-{3-allyl-4-[2-(2-ethylphenoxy)ethoxy]-5-methoxyphenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 5253-0802 |
Compound Name: | 3-{3-allyl-4-[2-(2-ethylphenoxy)ethoxy]-5-methoxyphenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
Molecular Weight: | 489.59 |
Molecular Formula: | C27 H27 N3 O4 S |
Smiles: | CCc1ccccc1OCCOc1c(CC=C)cc(/C=C(/C#N)C(Nc2nccs2)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 5.94 |
logD: | 5.67 |
logSw: | -7.19 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 119.53 |
InChI Key: | WUOPWXLRLQVXDQ-UHFFFAOYSA-N |