Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide
TL;DR: Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide (CAS 105375-27-7) is a chemical compound with molecular formula C33H48Br2N2 and molecular weight 630.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1-[7-(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane dibromide
Also Known As: 1,1'-Heptamethylenebis(3-phenylquinuclidinium bromide), Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide, 1,1'-(Heptane-1,7-diyl)bis(3-phenyl-1-azabicyclo[2.2.2]octan-1-ium) dibromide, 3-phenyl-1-[7-(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane dibromide, RefChem:378934
| Molecular Formula | C33H48Br2N2 |
|---|---|
| Molecular Weight | 630.22 g/mol |
| LogP | 0.9933 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 10 |
| Exact Mass | 630.21844 |
| Heavy Atoms | 37 |
| Complexity | 855.8101 |
Chemical Identifiers
| CAS Number | 105375-27-7 |
|---|---|
| SMILES | C1C[N+]2(CCC1C(C2)C3=CC=CC=C3)CCCCCCC[N+]45CCC(CC4)C(C5)C6=CC=CC=C6.[Br-].[Br-] |
Product Overview
Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide (CAS 105375-27-7), with molecular formula C33H48Br2N2 and molecular weight 630.22 g/mol. IUPAC: 3-phenyl-1-[7-(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane dibromide.
Chemical Property Profile of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide
Property Insights of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide
The XLogP value of 0.9933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide. With a topological polar surface area (TPSA) of 0.0 Ų, Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide 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'-heptamethylenebis(3-phenyl-, dibromide?
The CAS number of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide is 105375-27-7.
What is the molecular formula of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide?
The molecular formula of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide is C33H48Br2N2.
What is the molecular weight of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide?
The molecular weight of Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide is 630.22 g/mol.
Where can I buy Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide?
You can request a quote for Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide 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'-heptamethylenebis(3-phenyl-, dibromide?
Yes, KEHONG BIO provides custom synthesis services for Quinuclidinium, 1,1'-heptamethylenebis(3-phenyl-, dibromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.