TL;DR: 3H-imidazo[4,5-b]pyridin-4-ium-4-olate (CAS 1221715-22-5) is a chemical compound with molecular formula C6H5N3O and molecular weight 135.04326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-hydroxyimidazo[4,5-b]pyridine
Also Known As: 3H-Imidazo[4,5-b]pyridine, 4-oxide, 4-hydroxyimidazo[4,5-b]pyridine, 4h-imidazo[4,5-b]pyridin-4-ol, 1H-imidazo[4,5-b]pyridine 4-oxide, 3H-Imidazo[4,5-b]pyridine 4-oxide
| Molecular Formula | C6H5N3O |
| Molecular Weight | 135.04326 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.04326 Da |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
| SMILES | C1=CN(C2=NC=NC2=C1)O |
| InChIKey | REMGQFLUKHNBEN-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-imidazo[4,5-b]pyridin-4-ium-4-olate. With a topological polar surface area (TPSA) of 50.9 Ų, 3H-imidazo[4,5-b]pyridin-4-ium-4-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-imidazo[4,5-b]pyridin-4-ium-4-olate 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 3H-imidazo[4,5-b]pyridin-4-ium-4-olate is 1221715-22-5.
The molecular formula of 3H-imidazo[4,5-b]pyridin-4-ium-4-olate is C6H5N3O.
The molecular weight of 3H-imidazo[4,5-b]pyridin-4-ium-4-olate is 135.04326 g/mol.
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