ethyl 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
Chemical Structure Depiction of
ethyl 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
ethyl 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate
Compound characteristics
| Compound ID: | 6737-0998 |
| Compound Name: | ethyl 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C27 H31 N O7 |
| Smiles: | CCOC(C1=C(C(c2ccc(c(CN3CCCCC3C)c2O1)O)=O)c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0246 |
| logD: | 3.6061 |
| logSw: | -3.9421 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.708 |
| InChI Key: | XVOXEKUSJDKXBC-INIZCTEOSA-N |