1,4-bis{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}butane-1,4-dione
Chemical Structure Depiction of
1,4-bis{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}butane-1,4-dione
1,4-bis{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}butane-1,4-dione
Compound characteristics
| Compound ID: | Y500-7799 |
| Compound Name: | 1,4-bis{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}butane-1,4-dione |
| Molecular Weight: | 522.6 |
| Molecular Formula: | C28 H34 N4 O6 |
| Smiles: | C(CC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2797 |
| logD: | 0.9354 |
| logSw: | -1.9922 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.064 |
| InChI Key: | UEHXTICWVZQGHI-UHFFFAOYSA-N |