ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | Y500-0794 |
| Compound Name: | ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate |
| Molecular Weight: | 424.38 |
| Molecular Formula: | C20 H19 F3 N2 O5 |
| Smiles: | CCOC(CC1=C(C(C(C#N)=C(N)O1)c1ccccc1C(F)(F)F)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1773 |
| logD: | 3.1773 |
| logSw: | -3.548 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.799 |
| InChI Key: | PQTCOSWZYAKYCI-MRXNPFEDSA-N |