TL;DR: Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide (CAS 63982-08-1) is a chemical compound with molecular formula C38H48Br2N4 and molecular weight 718.22455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-carbazol-9-ylethyl-[6-[2-carbazol-9-ylethyl(dimethyl)azaniumyl]hexyl]-dimethylazanium dibromide
Also Known As: Hexamethylenebis(2-carbazol-9-ylethyl)dimethylammonium bromide, 1,6-Hexanediaminium, N,N'-bis(2-(9H-carbazol-9-yl)ethyl)-N,N,N',N'-tetramethyl-, dibromide, Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide, n,n'-bis[2-(9h-carbazol-9-yl)ethyl]-n,n,n',n'-tetramethylhexane-1,6-diaminium dibromide, 2-carbazol-9-ylethyl-[6-[2-carbazol-9-ylethyl(dimethyl)azaniumyl]hexyl]-dimethylazanium dibromide
| Molecular Formula | C38H48Br2N4 |
| Molecular Weight | 718.22455 g/mol |
| XLogP | 2.32 |
| Topological Polar Surface Area (TPSA) | 9.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 720.22253 Da |
| Heavy Atoms | 44 |
| Complexity | 727.0 |
| SMILES | C[N+](C)(CCCCCC[N+](C)(C)CCN1C2=CC=CC=C2C3=CC=CC=C31)CCN4C5=CC=CC=C5C6=CC=CC=C64.[Br-].[Br-] |
| InChIKey | YFCHKDNALIQLJW-UHFFFAOYSA-L |
The XLogP value of 2.32 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide. With a topological polar surface area (TPSA) of 9.9 Ų, Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide is 63982-08-1.
The molecular formula of Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide is C38H48Br2N4.
The molecular weight of Ammonium, hexamethylenebis((beta-carbazol-9-ylethyl)dimethyl-, dibromide is 718.22455 g/mol.
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