methyl (6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-yl)(oxo)acetate
Chemical Structure Depiction of
methyl (6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-yl)(oxo)acetate
methyl (6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-yl)(oxo)acetate
Compound characteristics
| Compound ID: | 8020-2656 |
| Compound Name: | methyl (6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-yl)(oxo)acetate |
| Molecular Weight: | 298.3 |
| Molecular Formula: | C16 H14 N2 O4 |
| Smiles: | CC1=C(C(C(C#N)=C(N)O1)c1ccccc1)C(C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4803 |
| logD: | 1.4803 |
| logSw: | -1.808 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.605 |
| InChI Key: | OMDILVWFACCYQK-CYBMUJFWSA-N |