氯化海喹铵
TL;DR: 氯化海喹铵 (CAS 4310-89-8) is a chemical compound with molecular formula C34H46Cl2N2 and molecular weight 552.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯化海喹铵
2-(16-isoquinolin-2-ium-2-ylhexadecyl)isoquinolin-2-ium dichloride
Also Known As: Hedaquinium chloride, Teoquil, Teoquil chloride, Cloruro de hedaquinio, Hedaquinii chloridum
| Molecular Formula | C34H46Cl2N2 |
|---|---|
| Molecular Weight | 552.30 g/mol |
| LogP | 2.74 |
| Topological Polar Surface Area | 7.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 552.30383 |
| Heavy Atoms | 38 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 4310-89-8 |
|---|---|
| SMILES | C1=CC=C2C=[N+](C=CC2=C1)CCCCCCCCCCCCCCCC[N+]3=CC4=CC=CC=C4C=C3.[Cl-].[Cl-] |
| InChIKey | KZUZUJNAVUAVOW-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯化海喹铵 (CAS 4310-89-8), with molecular formula C34H46Cl2N2 and molecular weight 552.30 g/mol. IUPAC: 2-(16-isoquinolin-2-ium-2-ylhexadecyl)isoquinolin-2-ium dichloride.
Chemical Property Profile of 氯化海喹铵
Property Insights of 氯化海喹铵
The XLogP value of 2.74 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯化海喹铵. With a topological polar surface area (TPSA) of 7.8 Ų, 氯化海喹铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯化海喹铵 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 氯化海喹铵?
The CAS number of 氯化海喹铵 is 4310-89-8.
What is the molecular formula of 氯化海喹铵?
The molecular formula of 氯化海喹铵 is C34H46Cl2N2.
What is the molecular weight of 氯化海喹铵?
The molecular weight of 氯化海喹铵 is 552.30 g/mol.
Where can I buy 氯化海喹铵?
You can request a quote for 氯化海喹铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯化海喹铵?
Yes, KEHONG BIO provides custom synthesis services for 氯化海喹铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.