TL;DR: 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL (CAS 1000340-51-1) is a chemical compound with molecular formula C11H16N4O3 and molecular weight 252.12224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(3-nitro-2-pyridinyl)piperazin-1-yl]ethanol
Also Known As: Maybridge1_000397, 2-[4-(3-nitro-2-pyridinyl)piperazino]-1-ethanol, 2-[4-(3-NITRO-2-PYRIDYL)PIPERAZINO]ETHAN-1-OL, 4-chloro-1H-pyrazol-3-amine, 2-[4-(3-nitropyridin-2-yl)piperazin-1-yl]ethanol
| Molecular Formula | C11H16N4O3 |
| Molecular Weight | 252.12224 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 85.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.12224 Da |
| Heavy Atoms | 18 |
| Complexity | 276.0 |
| SMILES | C1CN(CCN1CCO)C2=C(C=CC=N2)[N+](=O)[O-] |
| InChIKey | SQZXOFMVKVJHBQ-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL. Following Lipinski's Rule of Five, 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL is 1000340-51-1.
The molecular formula of 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL is C11H16N4O3.
The molecular weight of 2-[4-(3-Nitro-2-pyridyl)piperazino]ethan-1-OL is 252.12224 g/mol.
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