3-{3-allyl-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{3-allyl-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{3-allyl-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0709 |
| Compound Name: | 3-{3-allyl-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 489.53 |
| Molecular Formula: | C27 H27 N3 O6 |
| Smiles: | Cc1cc(NC(C(=C/c2cc(CC=C)c(c(c2)OC)OCCOc2ccccc2OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.07 |
| logD: | 3.55 |
| logSw: | -5.84 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 174.55 |
| InChI Key: | UXWIVHVJSYLLQZ-UHFFFAOYSA-N |