ethyl 7-hydroxy-3-(4-methoxyphenyl)-8-[(3-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
Chemical Structure Depiction of
ethyl 7-hydroxy-3-(4-methoxyphenyl)-8-[(3-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
ethyl 7-hydroxy-3-(4-methoxyphenyl)-8-[(3-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
Compound characteristics
| Compound ID: | 6737-0960 |
| Compound Name: | ethyl 7-hydroxy-3-(4-methoxyphenyl)-8-[(3-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C26 H29 N O6 |
| Smiles: | CCOC(C1=C(C(c2ccc(c(CN3CCCC(C)C3)c2O1)O)=O)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.439 |
| logD: | 4.0169 |
| logSw: | -3.8879 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.474 |
| InChI Key: | QQTWWOQRDDRKSV-INIZCTEOSA-N |