Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-
TL;DR: Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- (CAS 35064-63-2) is a chemical compound with molecular formula C20H25N2O2+ and molecular weight 325.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(R)-[(2S,4S,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
Also Known As: Quinine, quinine(1+), Chinine, (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium, (R)-[(2S,4S,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
| Molecular Formula | C20H25N2O2+ |
|---|---|
| Molecular Weight | 325.19 g/mol |
| LogP | 1.7561 |
| Topological Polar Surface Area | 46.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.1916 |
| Heavy Atoms | 24 |
| Complexity | 760.3873 |
Chemical Identifiers
| CAS Number | 35064-63-2 |
|---|---|
| SMILES | COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CC[NH+]3C[C@@H]4C=C)O |
Product Overview
Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- (CAS 35064-63-2), with molecular formula C20H25N2O2+ and molecular weight 325.19 g/mol. IUPAC: (R)-[(2S,4S,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol.
Chemical Property Profile of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-
Property Insights of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-
The XLogP value of 1.7561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-. With a topological polar surface area (TPSA) of 46.79 Ų, Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-?
The CAS number of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- is 35064-63-2.
What is the molecular formula of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-?
The molecular formula of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- is C20H25N2O2+.
What is the molecular weight of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-?
The molecular weight of Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- is 325.19 g/mol.
Where can I buy Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-?
You can request a quote for Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)-?
Yes, KEHONG BIO provides custom synthesis services for Cinchonan-9-ol, 6'-methoxy-, conjugate diacid, (8alpha,9R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.