2-cyano-3-{4-[3-(2,6-dimethylphenoxy)propoxy]-3-methoxyphenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[3-(2,6-dimethylphenoxy)propoxy]-3-methoxyphenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{4-[3-(2,6-dimethylphenoxy)propoxy]-3-methoxyphenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0473 |
| Compound Name: | 2-cyano-3-{4-[3-(2,6-dimethylphenoxy)propoxy]-3-methoxyphenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H27 N3 O5 |
| Smiles: | Cc1cccc(C)c1OCCCOc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.42 |
| logD: | 3.91 |
| logSw: | -6.36 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 169.89 |
| InChI Key: | XROAPVNFCRTWKD-UHFFFAOYSA-N |