3-{3-bromo-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{3-bromo-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{3-bromo-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0293 |
| Compound Name: | 3-{3-bromo-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 528.36 |
| Molecular Formula: | C24 H22 Br N3 O6 |
| Smiles: | Cc1cc(NC(C(=C/c2cc(c(c(c2)[Br])OCCOc2ccc(cc2)OC)OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5 |
| logD: | 3.48 |
| logSw: | -6.11 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 186.94 |
| InChI Key: | RUNAWIYRYQMGRG-UHFFFAOYSA-N |