3-(3-allyl-4-hydroxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-(3-allyl-4-hydroxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-(3-allyl-4-hydroxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0426 |
| Compound Name: | 3-(3-allyl-4-hydroxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C18 H17 N3 O4 |
| Smiles: | Cc1cc(NC(C(=C/c2cc(CC=C)c(c(c2)OC)O)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.57 |
| logD: | 2.05 |
| logSw: | -4.29 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 189.3 |
| InChI Key: | AHYHMURFUJAGAS-UHFFFAOYSA-N |