2-(1-{[2-(3,4-diethoxyphenyl)ethyl]amino}butylidene)-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-(1-{[2-(3,4-diethoxyphenyl)ethyl]amino}butylidene)-5,5-dimethylcyclohexane-1,3-dione
2-(1-{[2-(3,4-diethoxyphenyl)ethyl]amino}butylidene)-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8014-2759 |
| Compound Name: | 2-(1-{[2-(3,4-diethoxyphenyl)ethyl]amino}butylidene)-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 401.55 |
| Molecular Formula: | C24 H35 N O4 |
| Smiles: | CCCC(=C1C(CC(C)(C)CC1=O)=O)NCCc1ccc(c(c1)OCC)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.6411 |
| logD: | 3.6146 |
| logSw: | -3.7568 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.928 |
| InChI Key: | MCMPJAAXAKSHQM-UHFFFAOYSA-N |