methyl 4-{3-[4-(4-benzoylphenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-[4-(4-benzoylphenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
methyl 4-{3-[4-(4-benzoylphenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 8016-7445 |
| Compound Name: | methyl 4-{3-[4-(4-benzoylphenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | COC(c1ccc(cc1)N1C(CC(C1=O)N1CCN(CC1)c1ccc(cc1)C(c1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1872 |
| logD: | 3.1872 |
| logSw: | -3.2672 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.889 |
| InChI Key: | YEEMQQOZYZEGHZ-VWLOTQADSA-N |