bis(2-methylpropyl) 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
bis(2-methylpropyl) 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
bis(2-methylpropyl) 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 8014-2284 |
| Compound Name: | bis(2-methylpropyl) 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 447.57 |
| Molecular Formula: | C25 H37 N O6 |
| Smiles: | CC(C)COC(C1C(C(C(=O)OCC(C)C)C(C)(CC1=O)O)c1ccc(cc1)N(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4166 |
| logD: | 4.397 |
| logSw: | -4.3957 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.795 |
| InChI Key: | KAHRRBTTZSYVLT-UHFFFAOYSA-N |