Quinine propyl bromide
TL;DR: Quinine propyl bromide (CAS 63717-12-4) is a chemical compound with molecular formula C23H31BrN2O2 and molecular weight 446.1569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(S)-[(2R)-5-ethenyl-1-propyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol bromide
Also Known As: Quinine propyl bromide, Quinine, n-propyl bromide, 9-Hydroxy-6'-methoxy-1-propylcinchonan-1-ium bromide, CINCHONAN-9-OL, 6'-METHOXY-, (8-alpha,9R)-, compd. with 1-BROMOPROPANE (1:1), Propane, 1-bromo-, compd. with (8alpha,9R)-6'methoxycinchonan-9-ol (1:1)
Technical Specifications
| Molecular Formula | C23H31BrN2O2 |
| Molecular Weight | 446.1569 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.1569 Da |
| Heavy Atoms | 28 |
| Complexity | 527.0 |
| SMILES | CCC[N+]12CCC(C[C@@H]1[C@H](C3=C4C=C(C=CC4=NC=C3)OC)O)C(C2)C=C.[Br-] |
| InChIKey | DSXBQRQLQMPKOA-XJXJHPFJSA-M |
Chemical Property Profile of Quinine propyl bromide
Property Insights of Quinine propyl bromide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinine propyl bromide. With a topological polar surface area (TPSA) of 42.4 Ų, Quinine propyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinine propyl bromide 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
What is the CAS number of Quinine propyl bromide?
The CAS number of Quinine propyl bromide is 63717-12-4.
What is the molecular formula of Quinine propyl bromide?
The molecular formula of Quinine propyl bromide is C23H31BrN2O2.
What is the molecular weight of Quinine propyl bromide?
The molecular weight of Quinine propyl bromide is 446.1569 g/mol.
Where can I buy Quinine propyl bromide?
You can request a quote for Quinine propyl bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Quinine propyl bromide?
Yes, CoreyChem provides custom synthesis services for Quinine propyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.