TL;DR: 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline (CAS 160315-07-1) is a chemical compound with molecular formula C9H5ClN4 and molecular weight 204.02028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-2H-pyrazolo[4,3-b]quinoxaline
Also Known As: 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline, 3-chloro-2H-pyrazolo[4,3-b]quinoxaline, pyrazolo[3,4-b]quinoxaline deriv. 7, 3-chloropyrazolo[4,5-b]quinoxaline, 3-Chloro-2H-pyrazolo[3,4-b]quinoxaline
| Molecular Formula | C9H5ClN4 |
| Molecular Weight | 204.02028 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 54.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.02028 Da |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
| SMILES | C1=CC2=NC3=C(NN=C3N=C2C=C1)Cl |
| InChIKey | GHSHUHWQXKLQIU-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline. With a topological polar surface area (TPSA) of 54.5 Ų, 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline is 160315-07-1.
The molecular formula of 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline is C9H5ClN4.
The molecular weight of 3-Chloro-1H-pyrazolo[3,4-b]quinoxaline is 204.02028 g/mol.
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