TL;DR: 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine (CAS 101857-28-7) is a chemical compound with molecular formula C6H3ClN4O2 and molecular weight 197.99445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-7-nitro-1H-imidazo[4,5-b]pyridine
Also Known As: 5-Chloro-7-nitro-3H-imidazo[4,5-b]pyridine, 3H-Imidazo[4,5-b]pyridine, 5-chloro-7-nitro-, 5-chloro-7-nitro-1H-imidazo[4,5-b]pyridine, 5-Chloro-7-nitro-3H-imidazo[4,5-b]pyridine #, 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine
| Molecular Formula | C6H3ClN4O2 |
| Molecular Weight | 197.99445 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 87.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.99445 Da |
| Heavy Atoms | 13 |
| Complexity | 221.0 |
| SMILES | C1=C(C2=C(N=CN2)N=C1Cl)[N+](=O)[O-] |
| InChIKey | IWQHZTCGVPZMSR-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine. The TPSA of 87.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine. Following Lipinski's Rule of Five, 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine is 101857-28-7.
The molecular formula of 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine is C6H3ClN4O2.
The molecular weight of 5-Chloro-7-nitro-3H-imidazole-[4,5-b]pyridine is 197.99445 g/mol.
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