5-(3,4-dimethoxyphenyl)-2-({[2-(piperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-({[2-(piperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
5-(3,4-dimethoxyphenyl)-2-({[2-(piperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4506-0561 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-({[2-(piperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C21 H29 N3 O4 |
| Smiles: | COc1ccc(cc1OC)C1CC(C(=CNCCN2CCNCC2)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.381 |
| logD: | -1.0709 |
| logSw: | -1.8899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.561 |
| InChI Key: | HCVWQGSVMAEZOV-UHFFFAOYSA-N |