TL;DR: 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one (CAS 163452-73-1) is a chemical compound with molecular formula C7H6BrN3O and molecular weight 226.96942 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-bromo-1-methyl-5H-imidazo[4,5-c]pyridin-4-one
Also Known As: 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one, 7-bromo-1-methyl-5H-imidazo[4,5-c]pyridin-4-one, 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4-ol, 7-Bromo-1-methyl-1H-imidazo(4,5-c)pyridin-4(5H)-one, 7-bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one(WXC05963)
| Molecular Formula | C7H6BrN3O |
| Molecular Weight | 226.96942 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.96942 Da |
| Heavy Atoms | 12 |
| Complexity | 253.0 |
| SMILES | CN1C=NC2=C1C(=CNC2=O)Br |
| InChIKey | RXERNKSTSSWUPU-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one. With a topological polar surface area (TPSA) of 46.9 Ų, 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one is 163452-73-1.
The molecular formula of 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one is C7H6BrN3O.
The molecular weight of 7-Bromo-1-methyl-1H-imidazo[4,5-c]pyridin-4(5H)-one is 226.96942 g/mol.
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