3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0005 |
| Compound Name: | 3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 453.88 |
| Molecular Formula: | C23 H20 Cl N3 O5 |
| Smiles: | Cc1cc(NC(C(=C/c2cc(c(c(c2)[Cl])OCCOc2ccccc2)OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.09 |
| logD: | 3.57 |
| logSw: | -6.09 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 174.42 |
| InChI Key: | UXYRISMRHAGFKO-UHFFFAOYSA-N |