O-Desmethyl Quinidine
TL;DR: O-Desmethyl Quinidine (CAS 70877-75-7) is a chemical compound with molecular formula C19H22N2O2 and molecular weight 310.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]quinolin-6-ol
Also Known As: Cupreidine, Cupreine, Demethylquinidine, O-Desmethylquinidine, O-Demethylquinidine
| Molecular Formula | C19H22N2O2 |
|---|---|
| Molecular Weight | 310.17 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 56.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.16812 |
| Heavy Atoms | 23 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 70877-75-7 |
|---|---|
| SMILES | C=CC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)O)O |
| InChIKey | VJFMSYZSFUWQPZ-UHFFFAOYSA-N |
Product Overview
O-Desmethyl Quinidine (CAS 70877-75-7), with molecular formula C19H22N2O2 and molecular weight 310.17 g/mol. IUPAC: 4-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]quinolin-6-ol.
Chemical Property Profile of O-Desmethyl Quinidine
Property Insights of O-Desmethyl Quinidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Desmethyl Quinidine. With a topological polar surface area (TPSA) of 56.6 Ų, O-Desmethyl Quinidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Desmethyl Quinidine has 2 hydrogen bond donor(s) and 4 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 O-Desmethyl Quinidine?
The CAS number of O-Desmethyl Quinidine is 70877-75-7.
What is the molecular formula of O-Desmethyl Quinidine?
The molecular formula of O-Desmethyl Quinidine is C19H22N2O2.
What is the molecular weight of O-Desmethyl Quinidine?
The molecular weight of O-Desmethyl Quinidine is 310.17 g/mol.
Where can I buy O-Desmethyl Quinidine?
You can request a quote for O-Desmethyl Quinidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Desmethyl Quinidine?
Yes, KEHONG BIO provides custom synthesis services for O-Desmethyl Quinidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.