硫酸奎宁(USP)
TL;DR: 硫酸奎宁(USP) (CAS 6119-70-6) is a chemical compound with molecular formula C40H54N4O10S and molecular weight 782.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸奎宁(USP)
bis((R)-[(2S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol);sulfuric acid;dihydrate
Also Known As: quinine sulfate, Biquinate, Qualaquin, Quinamm, Mixture Name
| Molecular Formula | C40H54N4O10S |
|---|---|
| Molecular Weight | 782.36 g/mol |
| LogP | 4.04 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 782.3561 |
| Heavy Atoms | 55 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 6119-70-6 |
|---|---|
| SMILES | COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O.COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O.O.O.OS(=O)(=O)O |
| InChIKey | ZHNFLHYOFXQIOW-LRXYSQQVSA-N |
Product Overview
硫酸奎宁(USP) (CAS 6119-70-6), with molecular formula C40H54N4O10S and molecular weight 782.36 g/mol. IUPAC: bis((R)-[(2S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol);sulfuric acid;dihydrate.
Chemical Property Profile of 硫酸奎宁(USP)
Property Insights of 硫酸奎宁(USP)
The XLogP value of 4.04 indicates that 硫酸奎宁(USP) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 176.0 Ų indicates high polarity, suggesting 硫酸奎宁(USP) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸奎宁(USP) has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸奎宁(USP)?
The CAS number of 硫酸奎宁(USP) is 6119-70-6.
What is the molecular formula of 硫酸奎宁(USP)?
The molecular formula of 硫酸奎宁(USP) is C40H54N4O10S.
What is the molecular weight of 硫酸奎宁(USP)?
The molecular weight of 硫酸奎宁(USP) is 782.36 g/mol.
Where can I buy 硫酸奎宁(USP)?
You can request a quote for 硫酸奎宁(USP) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸奎宁(USP)?
Yes, KEHONG BIO provides custom synthesis services for 硫酸奎宁(USP) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.