2-[(propan-2-yl)oxy]ethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-[(propan-2-yl)oxy]ethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-[(propan-2-yl)oxy]ethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0209 |
| Compound Name: | 2-[(propan-2-yl)oxy]ethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 543.62 |
| Molecular Formula: | C32 H33 N O7 |
| Smiles: | CC(C)OCCOC(C1C(C2=COc3ccccc3C2=O)C2=C(CC(CC2=O)c2ccccc2OC)NC=1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8386 |
| logD: | 0.1693 |
| logSw: | -4.6316 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.422 |
| InChI Key: | BDGMDICTFAUOEB-UHFFFAOYSA-N |