TL;DR: 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine (CAS 112940-57-5) is a chemical compound with molecular formula C15H16N4O2 and molecular weight 284.12732 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-nitrophenyl)-4-pyridin-2-ylpiperazine
Also Known As: 1-(4-nitrophenyl)-4-(2-pyridyl)piperazine, piperazine,1-(4-nitrophenyl)-4-(2-pyridinyl)-, 1-(4-nitrophenyl)-4-pyridin-2-yl-piperazine, 1-(4-Nitro-phenyl)-4-pyridin-2-yl-piperazine, 1-(4-Nitrophenyl)-4-(pyridin-2-yl)piperazine
| Molecular Formula | C15H16N4O2 |
| Molecular Weight | 284.12732 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.12732 Da |
| Heavy Atoms | 21 |
| Complexity | 344.0 |
| SMILES | C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=N3 |
| InChIKey | CUOTYNOZPMJLBX-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine is 112940-57-5.
The molecular formula of 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine is C15H16N4O2.
The molecular weight of 1-(4-Nitrophenyl)-4-(2-pyridyl)piperazine is 284.12732 g/mol.
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