TL;DR: Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide (CAS 15471-43-9) is a chemical compound with molecular formula C14H24I2N2 and molecular weight 474.0029 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide
Also Known As: ISOINDOLINIUM, 2-METHYL-2-(beta-(TRIMETHYLAMMONIO)ETHYL)-, DIIODIDE, Ammonium, (2-(2-methyl-4,5,6,7-tetrachloroisoindolinio)ethyl)trimethyl-, diiodide, Isoindolinium, 2-methyl-2-[2-(trimethylammonio)ethyl]-, diiodide, 2-Methyl-2-[2-(trimethylazaniumyl)ethyl]-2,3-dihydro-1H-isoindol-2-ium diiodide, trimethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide
| Molecular Formula | C14H24I2N2 |
| Molecular Weight | 474.0029 g/mol |
| XLogP | -4.14 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 474.0029 Da |
| Heavy Atoms | 18 |
| Complexity | 228.0 |
| SMILES | C[N+]1(CC2=CC=CC=C2C1)CC[N+](C)(C)C.[I-].[I-] |
| InChIKey | TYNQJNYAIIACFM-UHFFFAOYSA-L |
The XLogP value of -4.14 indicates that Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide is 15471-43-9.
The molecular formula of Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide is C14H24I2N2.
The molecular weight of Isoindolinium, 2-methyl-2-(beta-(trimethylammonio)ethyl)-, diiodide is 474.0029 g/mol.
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