TL;DR: Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide (CAS 109965-42-6) is a chemical compound with molecular formula C17H37Br2N3 and molecular weight 441.1354 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-2-(1-methylpiperidin-1-ium-1-yl)-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]ethanamine dibromide
Also Known As: Azapiperonium, Bis(beta-methyl-piperidinio-ethyl)-methylamine dibromide, 1,1'-((Methylimino)diethylene)bis(1-methylpiperidinium bromide), Dwubromek metylo-bis(beta-metylopiperydinio-etylo)aminy [Polish], N,N',3-Trimethyl-N,N'-dipiperidyl-3-azapentane dibromide
| Molecular Formula | C17H37Br2N3 |
| Molecular Weight | 441.1354 g/mol |
| XLogP | -3.8128 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.1354 Da |
| Heavy Atoms | 22 |
| Complexity | 250.0 |
| SMILES | CN(CC[N+]1(CCCCC1)C)CC[N+]2(CCCCC2)C.[Br-].[Br-] |
| InChIKey | JXXZLCMDCGYBNA-UHFFFAOYSA-L |
The XLogP value of -3.8128 indicates that Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.2 Ų, Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide is 109965-42-6.
The molecular formula of Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide is C17H37Br2N3.
The molecular weight of Piperidinium, 1,1'-((methylimino)diethylene)bis(1-methyl-, dibromide is 441.1354 g/mol.
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