2-cyano-3-{4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0467 |
| Compound Name: | 2-cyano-3-{4-[3-(3-methoxyphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C24 H23 N3 O5 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(cc2)OCCCOc2cccc(c2)OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.07 |
| logD: | 3.55 |
| logSw: | -6.02 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 185.15 |
| InChI Key: | JKFXRXDDTHQKGV-UHFFFAOYSA-N |