3-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0297 |
| Compound Name: | 3-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 467.91 |
| Molecular Formula: | C24 H22 Cl N3 O5 |
| Smiles: | Cc1cc(ccc1[Cl])OCCOc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.5 |
| logD: | 3.98 |
| logSw: | -6.36 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 182.28 |
| InChI Key: | LXFZFPXUHQDUIB-UHFFFAOYSA-N |