2-cyano-N~1~-(5-methyl-3-isoxazolyl)-3-[4-(2-phenoxyethoxy)phenyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-methyl-3-isoxazolyl)-3-[4-(2-phenoxyethoxy)phenyl]acrylamide
2-cyano-N~1~-(5-methyl-3-isoxazolyl)-3-[4-(2-phenoxyethoxy)phenyl]acrylamide
Compound characteristics
| Compound ID: | C482-0001 |
| Compound Name: | 2-cyano-N~1~-(5-methyl-3-isoxazolyl)-3-[4-(2-phenoxyethoxy)phenyl]acrylamide |
| Molecular Weight: | 389.41 |
| Molecular Formula: | C22 H19 N3 O4 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(cc2)OCCOc2ccccc2)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.53 |
| logD: | 3.01 |
| logSw: | -5.17 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 176.23 |
| InChI Key: | RLVPJTMBVDTZBQ-UHFFFAOYSA-N |