Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride
TL;DR: Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride (CAS 3563-63-1) is a chemical compound with molecular formula C34H50Cl2N2 and molecular weight 556.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-1-[6-(3-benzyl-1-azoniabicyclo[2.2.2]octan-1-yl)hexyl]-1-azoniabicyclo[2.2.2]octane dichloride
Also Known As: Diquine, Qualidil, Quebrachitol, Kvalidil, Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride
| Molecular Formula | C34H50Cl2N2 |
|---|---|
| Molecular Weight | 556.34 g/mol |
| LogP | 0.7534 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 11 |
| Exact Mass | 556.3351 |
| Heavy Atoms | 38 |
| Complexity | 869.4658 |
Chemical Identifiers
| CAS Number | 3563-63-1 |
|---|---|
| SMILES | C1C[N+]2(CCC1C(C2)CC3=CC=CC=C3)CCCCCC[N+]45CCC(CC4)C(C5)CC6=CC=CC=C6.[Cl-].[Cl-] |
Product Overview
Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride (CAS 3563-63-1), with molecular formula C34H50Cl2N2 and molecular weight 556.34 g/mol. IUPAC: 3-benzyl-1-[6-(3-benzyl-1-azoniabicyclo[2.2.2]octan-1-yl)hexyl]-1-azoniabicyclo[2.2.2]octane dichloride.
Chemical Property Profile of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride
Property Insights of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride
The XLogP value of 0.7534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride. With a topological polar surface area (TPSA) of 0.0 Ų, Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride?
The CAS number of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride is 3563-63-1.
What is the molecular formula of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride?
The molecular formula of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride is C34H50Cl2N2.
What is the molecular weight of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride?
The molecular weight of Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride is 556.34 g/mol.
Where can I buy Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride?
You can request a quote for Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride?
Yes, KEHONG BIO provides custom synthesis services for Quinuclidinium, 1,1'-hexamethylenebis(3-benzyl-, dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.