TL;DR: RefChem:378761 (CAS 113611-76-0) is a chemical compound with molecular formula C25H42I2N2O2Si and molecular weight 684.1105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[3-[methyl(dipropyl)silyl]propyl]-[2-(1-methylquinolin-1-ium-2-carbonyl)oxyethyl]azanium diiodide
Also Known As: Quinolinium, 2-((2-(dimethyl(3-(methyldipropylsilyl)propyl)ammonio)ethoxy)carbonyl)-1-methyl-,diiodide, 2-{[2-(Dimethyl{3-[methyl(dipropyl)silyl]propyl}azaniumyl)ethoxy]carbonyl}-1-methylquinolin-1-ium diiodide, 2-{[2-(Dimethyl{3-[methyldi(propyl)silyl]propyl}azaniumyl)ethoxy]carbonyl}-1-methylquinolin-1-ium diiodide, dimethyl-[3-[methyl(dipropyl)silyl]propyl]-[2-(1-methylquinolin-1-ium-2-carbonyl)oxyethyl]azanium diiodide
| Molecular Formula | C25H42I2N2O2Si |
| Molecular Weight | 684.1105 g/mol |
| XLogP | -0.8058 |
| Topological Polar Surface Area (TPSA) | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 684.1105 Da |
| Heavy Atoms | 32 |
| Complexity | 519.0 |
| SMILES | CCC[Si](C)(CCC)CCC[N+](C)(C)CCOC(=O)C1=[N+](C2=CC=CC=C2C=C1)C.[I-].[I-] |
| InChIKey | GXIWBNMZFADZCF-UHFFFAOYSA-L |
The XLogP value of -0.8058 indicates that RefChem:378761 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.2 Ų, RefChem:378761 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:378761 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:378761 is 113611-76-0.
The molecular formula of RefChem:378761 is C25H42I2N2O2Si.
The molecular weight of RefChem:378761 is 684.1105 g/mol.
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