methyl 6-amino-5-cyano-2-methyl-4-[4-(propan-2-yl)phenyl]-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 6-amino-5-cyano-2-methyl-4-[4-(propan-2-yl)phenyl]-4H-pyran-3-carboxylate
methyl 6-amino-5-cyano-2-methyl-4-[4-(propan-2-yl)phenyl]-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-3662 |
| Compound Name: | methyl 6-amino-5-cyano-2-methyl-4-[4-(propan-2-yl)phenyl]-4H-pyran-3-carboxylate |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C18 H20 N2 O3 |
| Smiles: | CC(C)c1ccc(cc1)C1C(C#N)=C(N)OC(C)=C1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0173 |
| logD: | 3.0173 |
| logSw: | -3.2827 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.866 |
| InChI Key: | YEIJKFUDXKQNNX-MRXNPFEDSA-N |