TL;DR: Ruthenium chloride-dmso(2)-4-nitroimidazole(2) (CAS 105313-65-3) is a chemical compound with molecular formula C10H16Cl2N6O6RuS2 and molecular weight 551.8993 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(methylsulfinylmethyl)-3-[[(S)-methylsulfinyl]methyl]-4-nitro-1,2-dihydroimidazole;5-nitro-1H-imidazole;ruthenium(2+);dichloride
Also Known As: Ru-Dmso-NI, Ruthenium chloride-dmso(2)-4-nitroimidazole(2), Ruthenium, dichlorobis(4-nitro-1H-imidazole-N3)bis(sulfinylbis(methane)-S)-, 2-(methylsulfinylmethyl)-3-[[(S)-methylsulfinyl]methyl]-4-nitro-1,2-dihydroimidazole,5-nitro-1H-imidazole,ruthenium(2+),dichloride, 2-(methylsulfinylmethyl)-3-[[(S)-methylsulfinyl]methyl]-4-nitro-1,2-dihydroimidazole;5-nitro-1H-imidazole;ruthenium(2+);dichloride
| Molecular Formula | C10H16Cl2N6O6RuS2 |
| Molecular Weight | 551.8993 g/mol |
| XLogP | -6.6688 |
| Topological Polar Surface Area (TPSA) | 208.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 551.8993 Da |
| Heavy Atoms | 27 |
| Complexity | 464.0 |
| SMILES | C[S@](=O)CN1C(NC=C1[N+](=O)[O-])CS(=O)C.C1=C(NC=N1)[N+](=O)[O-].[Cl-].[Cl-].[Ru+2] |
| InChIKey | RNXLPDZXEDSQGY-DQTCTKDTSA-L |
The XLogP value of -6.6688 indicates that Ruthenium chloride-dmso(2)-4-nitroimidazole(2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.0 Ų indicates high polarity, suggesting Ruthenium chloride-dmso(2)-4-nitroimidazole(2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ruthenium chloride-dmso(2)-4-nitroimidazole(2) has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ruthenium chloride-dmso(2)-4-nitroimidazole(2) is 105313-65-3.
The molecular formula of Ruthenium chloride-dmso(2)-4-nitroimidazole(2) is C10H16Cl2N6O6RuS2.
The molecular weight of Ruthenium chloride-dmso(2)-4-nitroimidazole(2) is 551.8993 g/mol.
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