TL;DR: RefChem:1093362 (CAS 63982-09-2) is a chemical compound with molecular formula C40H50Br2N2 and molecular weight 716.2341 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[diethyl(9H-fluoren-9-yl)azaniumyl]hexyl-diethyl-(9H-fluoren-9-yl)azanium dibromide
Also Known As: C40H50N2.2Br.1/2H2O, 1,6-Bis(9-fluorenyldiethyl-ammonium)hexane bromide, C40-H50-N2.2Br.1/2H2-O, AMMONIUM, HEXAMETHYLENEBIS(FLUOREN-9-YLDIETHYL-, DIBROMIDE, Hexamethylenebis(diethyl-(9-fluorenyl)ammonium bromide) hemihydrate
| Molecular Formula | C40H50Br2N2 |
| Molecular Weight | 716.2341 g/mol |
| XLogP | 3.81 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 718.23206 Da |
| Heavy Atoms | 44 |
| Complexity | 715.0 |
| SMILES | CC[N+](CC)(CCCCCC[N+](CC)(CC)C1C2=CC=CC=C2C3=CC=CC=C13)C4C5=CC=CC=C5C6=CC=CC=C46.[Br-].[Br-] |
| InChIKey | IHXOCADAVBSZJN-UHFFFAOYSA-L |
The XLogP value of 3.81 indicates that RefChem:1093362 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:1093362 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1093362 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:1093362 is 63982-09-2.
The molecular formula of RefChem:1093362 is C40H50Br2N2.
The molecular weight of RefChem:1093362 is 716.2341 g/mol.
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