3-ethyl 6-methyl 2,7-dimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
3-ethyl 6-methyl 2,7-dimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
3-ethyl 6-methyl 2,7-dimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C119-0090 |
| Compound Name: | 3-ethyl 6-methyl 2,7-dimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 441.52 |
| Molecular Formula: | C25 H31 N O6 |
| Smiles: | CCOC(C1C(C2=C(CC(C)C(C2=O)C(=O)OC)NC=1C)c1ccccc1OC(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0896 |
| logD: | 0.2556 |
| logSw: | -4.2197 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.637 |
| InChI Key: | BCXXITKLCFHEPT-UHFFFAOYSA-N |