2-cyano-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0002 |
| Compound Name: | 2-cyano-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C23 H21 N3 O5 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccccc2)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.19 |
| logD: | 2.67 |
| logSw: | -4.82 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 183.14 |
| InChI Key: | OXZJIBITEGCSNK-UHFFFAOYSA-N |