4-[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]benzonitrile
4-[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | F116-0036 |
| Compound Name: | 4-[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]benzonitrile |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C24 H24 N4 O3 |
| Smiles: | C1CN(CCC1N1CCN(Cc2ccccc2)C(C1=O)=O)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8332 |
| logD: | 1.8332 |
| logSw: | -2.0003 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.183 |
| InChI Key: | SQYIGSPTANDVCS-UHFFFAOYSA-N |