3-[4-(3-phenyl-1H-pyrazol-5-yl)piperazine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
3-[4-(3-phenyl-1H-pyrazol-5-yl)piperazine-1-carbonyl]benzonitrile
3-[4-(3-phenyl-1H-pyrazol-5-yl)piperazine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | P804-0701 |
| Compound Name: | 3-[4-(3-phenyl-1H-pyrazol-5-yl)piperazine-1-carbonyl]benzonitrile |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C21 H19 N5 O |
| Smiles: | C1CN(CCN1C(c1cccc(C#N)c1)=O)c1cc(c2ccccc2)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.8072 |
| logD: | 2.8072 |
| logSw: | -3.3105 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.157 |
| InChI Key: | KATBZAIAXOKOJD-UHFFFAOYSA-N |