Dihydroquinine
TL;DR: Dihydroquinine (CAS 1452-29-5) is a chemical compound with molecular formula C20H26N2O2 and molecular weight 326.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(S)-[(4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
Also Known As: Dihydroquinine, KST-1A1454, (8xi,9s)-6'-methoxy-10,11-dihydrocinchonan-9-ol, (S)-[(4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
| Molecular Formula | C20H26N2O2 |
|---|---|
| Molecular Weight | 326.20 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.19943 |
| Heavy Atoms | 24 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 1452-29-5 |
|---|---|
| SMILES | CC[C@H]1CN2CC[C@H]1CC2[C@H](C3=C4C=C(C=CC4=NC=C3)OC)O |
| InChIKey | LJOQGZACKSYWCH-POOUTFPKSA-N |
Product Overview
Dihydroquinine (CAS 1452-29-5), with molecular formula C20H26N2O2 and molecular weight 326.20 g/mol. IUPAC: (S)-[(4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol.
Chemical Property Profile of Dihydroquinine
Property Insights of Dihydroquinine
The XLogP value of 3.1 indicates that Dihydroquinine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, Dihydroquinine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroquinine has 1 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 Dihydroquinine?
The CAS number of Dihydroquinine is 1452-29-5.
What is the molecular formula of Dihydroquinine?
The molecular formula of Dihydroquinine is C20H26N2O2.
What is the molecular weight of Dihydroquinine?
The molecular weight of Dihydroquinine is 326.20 g/mol.
Where can I buy Dihydroquinine?
You can request a quote for Dihydroquinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroquinine?
Yes, KEHONG BIO provides custom synthesis services for Dihydroquinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.