3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C142-0079 |
| Compound Name: | 3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C26 H27 N O8 |
| Smiles: | CC1CC2=C(C(C3=COc4ccccc4C3=O)C(=C(C)N2)C(=O)OCCOC)C(C1C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1367 |
| logD: | -1.8864 |
| logSw: | -3.0922 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.277 |
| InChI Key: | DYMIYPIGNVLNED-UHFFFAOYSA-N |