2-[2-(3,4-diethoxyphenyl)-1-(3-methoxyanilino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[2-(3,4-diethoxyphenyl)-1-(3-methoxyanilino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[2-(3,4-diethoxyphenyl)-1-(3-methoxyanilino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8015-1123 |
| Compound Name: | 2-[2-(3,4-diethoxyphenyl)-1-(3-methoxyanilino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 451.56 |
| Molecular Formula: | C27 H33 N O5 |
| Smiles: | CCOc1ccc(CC(=C2C(CC(C)(C)CC2=O)=O)Nc2cccc(c2)OC)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.6578 |
| logD: | 2.5886 |
| logSw: | -4.539 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.036 |
| InChI Key: | KNMVBPSEADYYGM-UHFFFAOYSA-N |