2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
Chemical Structure Depiction of
2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
Compound characteristics
| Compound ID: | 4393-0237 |
| Compound Name: | 2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one |
| Molecular Weight: | 359.46 |
| Molecular Formula: | C21 H29 N O4 |
| Smiles: | CCN(CC)c1ccc(cc1)C1C(C(C)=O)C(CC(C)(C1C(C)=O)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.288 |
| logD: | 1.4768 |
| logSw: | -2.3774 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.122 |
| InChI Key: | NBLIITIVEKGZFS-UHFFFAOYSA-N |