3-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
3-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidine-1-carbonyl}benzonitrile
3-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | M670-0178 |
| Compound Name: | 3-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C23 H22 N4 O |
| Smiles: | Cc1ccc(cc1)n1cc(cn1)C1CCN(CC1)C(c1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6111 |
| logD: | 3.6111 |
| logSw: | -3.4597 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 48.029 |
| InChI Key: | JHSOBQZOTUFTHP-UHFFFAOYSA-N |