methyl 6-amino-5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-(methoxymethyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 6-amino-5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-(methoxymethyl)-4H-pyran-3-carboxylate
methyl 6-amino-5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-(methoxymethyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8011-1244 |
| Compound Name: | methyl 6-amino-5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-(methoxymethyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 358.35 |
| Molecular Formula: | C18 H18 N2 O6 |
| Smiles: | COCC1=C(C(C(C#N)=C(N)O1)c1ccc(cc1)C(=O)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4355 |
| logD: | 1.4355 |
| logSw: | -1.8033 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.659 |
| InChI Key: | GITRKZFVWHRCGH-CQSZACIVSA-N |