TL;DR: 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol (CAS 108905-65-3) is a chemical compound with molecular formula C12H15BrN4OS and molecular weight 342.01498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanol
Also Known As: 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol, KST-1B0023, 1-[4-bromo-1-methyl-2-(methylsulfanyl)-1h-imidazol-5-yl]-2-(5-methylpyrazin-2-yl)ethanol, 1-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanol, 1-[4-Bromo-1-methyl-2-(methylsulfanyl)-1H-imidazol-5-yl]-2-(5-methylpyrazin-2-yl)ethan-1-ol
| Molecular Formula | C12H15BrN4OS |
| Molecular Weight | 342.01498 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.01498 Da |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
| SMILES | CC1=CN=C(C=N1)CC(C2=C(N=C(N2C)SC)Br)O |
| InChIKey | GLUFICPMRYAEOY-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol. Following Lipinski's Rule of Five, 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol is 108905-65-3.
The molecular formula of 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol is C12H15BrN4OS.
The molecular weight of 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanol is 342.01498 g/mol.
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