![Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate structure](/static/products/5949/5949-16-6.webp)
Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate
TL;DR: Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate (CAS 5949-16-6) is a chemical compound with molecular formula C38H46N4O6S and molecular weight 686.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate
Also Known As: Cinchonine sulfate, cinchonine, Cinchonine sulphate, Cinchonan-9(S)-ol hemisulfate salt, CINCHONINE, SULFATE (2:1) (salt)
| Molecular Formula | C38H46N4O6S |
|---|---|
| Molecular Weight | 686.31 g/mol |
| LogP | 2.16 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 686.3138 |
| Heavy Atoms | 49 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 5949-16-6 |
|---|---|
| SMILES | C=CC1C[NH+]2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.C=CC1C[NH+]2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.[O-]S(=O)(=O)[O-] |
| InChIKey | WBBHOISPYYYBTC-UHFFFAOYSA-N |
Product Overview
Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate (CAS 5949-16-6), with molecular formula C38H46N4O6S and molecular weight 686.31 g/mol. IUPAC: bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate.
Chemical Property Profile of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate
Property Insights of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate
The XLogP value of 2.16 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate. The TPSA of 164.0 Ų indicates high polarity, suggesting Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate?
The CAS number of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate is 5949-16-6.
What is the molecular formula of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate?
The molecular formula of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate is C38H46N4O6S.
What is the molecular weight of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate?
The molecular weight of Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate is 686.31 g/mol.
Where can I buy Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate?
You can request a quote for Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate?
Yes, KEHONG BIO provides custom synthesis services for Bis((5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol);sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.