3-cyclopentyl 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-cyclopentyl 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-cyclopentyl 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: | C142-0239 |
| Compound Name: | 3-cyclopentyl 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: | 481.59 |
| Molecular Formula: | C28 H35 N O6 |
| Smiles: | CC1CC2=C(C(C(=C(C)N2)C(=O)OC2CCCC2)c2ccccc2OC(C)C)C(C1C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8589 |
| logD: | 1.0249 |
| logSw: | -4.5926 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.333 |
| InChI Key: | KDLZEBWBENHNAW-UHFFFAOYSA-N |