4-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
4-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)benzonitrile
4-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | F116-0040 |
| Compound Name: | 4-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)benzonitrile |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C24 H23 F N4 O3 |
| Smiles: | C1CN(CCC1N1CCN(Cc2cccc(c2)F)C(C1=O)=O)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9554 |
| logD: | 1.9554 |
| logSw: | -2.2582 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.183 |
| InChI Key: | BPDQNTTYTHQQBD-UHFFFAOYSA-N |