2-{2-(3,4-diethoxyphenyl)-1-[(2-hydroxyethyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-{2-(3,4-diethoxyphenyl)-1-[(2-hydroxyethyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione
2-{2-(3,4-diethoxyphenyl)-1-[(2-hydroxyethyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8015-0791 |
| Compound Name: | 2-{2-(3,4-diethoxyphenyl)-1-[(2-hydroxyethyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C22 H31 N O5 |
| Smiles: | CCOc1ccc(CC(=C2C(CC(C)(C)CC2=O)=O)NCCO)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.1103 |
| logD: | 2.0971 |
| logSw: | -2.7197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.583 |
| InChI Key: | VMZPANOAIBGEAJ-UHFFFAOYSA-N |