TL;DR: 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide (CAS 109438-05-3) is a chemical compound with molecular formula C14H32I2N4 and molecular weight 510.07162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-(4,4-dimethylpiperazin-4-ium-1-yl)ethyl]-1,1-dimethylpiperazin-1-ium diiodide
Also Known As: 116 HC, SD 211-02, 4,4'-Ethylenebis(1,1-dimethylpiperazinium iodide), Piperazinium, 4,4'-ethylenebis(1,1-dimethyl-, diiodide, 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide
| Molecular Formula | C14H32I2N4 |
| Molecular Weight | 510.07162 g/mol |
| XLogP | -6.2216 |
| Topological Polar Surface Area (TPSA) | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 510.07162 Da |
| Heavy Atoms | 20 |
| Complexity | 227.0 |
| SMILES | C[N+]1(CCN(CC1)CCN2CC[N+](CC2)(C)C)C.[I-].[I-] |
| InChIKey | KLSPPSSCVKCYSY-UHFFFAOYSA-L |
The XLogP value of -6.2216 indicates that 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 6.5 Ų, 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide is 109438-05-3.
The molecular formula of 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide is C14H32I2N4.
The molecular weight of 4,4'-(Ethane-1,2-diyl)bis(1,1-dimethylpiperazin-1-ium) diiodide is 510.07162 g/mol.
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