2-[1-(benzylamino)-2-(3,4-diethoxyphenyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[1-(benzylamino)-2-(3,4-diethoxyphenyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[1-(benzylamino)-2-(3,4-diethoxyphenyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8015-0792 |
| Compound Name: | 2-[1-(benzylamino)-2-(3,4-diethoxyphenyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 435.56 |
| Molecular Formula: | C27 H33 N O4 |
| Smiles: | CCOc1ccc(CC(=C2C(CC(C)(C)CC2=O)=O)NCc2ccccc2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.1037 |
| logD: | 3.4069 |
| logSw: | -4.3271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.814 |
| InChI Key: | CTVWWTQPDUJIAH-UHFFFAOYSA-N |