ethyl 1-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3,4-dioxocyclobut-1-en-1-yl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3,4-dioxocyclobut-1-en-1-yl)piperidine-4-carboxylate
ethyl 1-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3,4-dioxocyclobut-1-en-1-yl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C667-0278 |
| Compound Name: | ethyl 1-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3,4-dioxocyclobut-1-en-1-yl)piperidine-4-carboxylate |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C24 H29 N3 O6 |
| Smiles: | CCOC(C1CCN(CC1)C1=C(C(C1=O)=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5774 |
| logD: | 2.5422 |
| logSw: | -2.8011 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.205 |
| InChI Key: | CEQXCVQVTAVGMF-UHFFFAOYSA-N |