[4-(4-nitrophenyl)piperazin-1-yl][1-phenyl-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
[4-(4-nitrophenyl)piperazin-1-yl][1-phenyl-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
[4-(4-nitrophenyl)piperazin-1-yl][1-phenyl-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-1385 |
| Compound Name: | [4-(4-nitrophenyl)piperazin-1-yl][1-phenyl-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 497 |
| Molecular Formula: | C25 H28 N6 O3 |
| Salt: | HCl |
| Smiles: | C1CNCCC1c1c(cnn1c1ccccc1)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.36 |
| logD: | -1.121 |
| logSw: | -2.8882 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.504 |
| InChI Key: | MRRFCIJGZSYEIO-UHFFFAOYSA-N |