4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)piperazine-2,5-dione
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)piperazine-2,5-dione
4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)piperazine-2,5-dione
Compound characteristics
| Compound ID: | K784-6589 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)piperazine-2,5-dione |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C28 H34 N2 O6 |
| Smiles: | CCOc1ccc(cc1OC)C1C(N(CC(N1Cc1ccc2c(c1)OCO2)=O)C1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3331 |
| logD: | 4.3331 |
| logSw: | -4.2742 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.235 |
| InChI Key: | GPUIPBUQTAVXCZ-MHZLTWQESA-N |