TL;DR: Diadonium (CAS 26660-43-5) is a chemical compound with molecular formula C32H54I2N2O4 and molecular weight 784.2173 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-adamantyl-[2-[4-[2-[1-adamantyl(dimethyl)azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl]-dimethylazanium diiodide
Also Known As: Diadonium, Diadonia, Diadony, Diadonium diiodide, 1-Adamantyl(2-hydroxyethyl)dimethylammonium iodide succinate (2:1)
| Molecular Formula | C32H54I2N2O4 |
| Molecular Weight | 784.2173 g/mol |
| XLogP | -1.05 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 784.2173 Da |
| Heavy Atoms | 40 |
| Complexity | 768.0 |
| SMILES | C[N+](C)(CCOC(=O)CCC(=O)OCC[N+](C)(C)C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5.[I-].[I-] |
| InChIKey | OUQJBAMGFRMBRL-UHFFFAOYSA-L |
The XLogP value of -1.05 indicates that Diadonium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, Diadonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diadonium has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Diadonium is 26660-43-5.
The molecular formula of Diadonium is C32H54I2N2O4.
The molecular weight of Diadonium is 784.2173 g/mol.
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