3-(butan-2-yl) 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-(butan-2-yl) 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-(butan-2-yl) 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: | C142-0353 |
| Compound Name: | 3-(butan-2-yl) 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: | 469.58 |
| Molecular Formula: | C27 H35 N O6 |
| Smiles: | CCC(C)OC(C1C(C2=C(CC(C)C(C2=O)C(=O)OC)NC=1C)c1ccccc1OC(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2973 |
| logD: | 1.4633 |
| logSw: | -5.3071 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.199 |
| InChI Key: | OKMKYMQOSYTWSJ-UHFFFAOYSA-N |