地喹氯铵
TL;DR: 地喹氯铵 (CAS 522-51-0) is a chemical compound with molecular formula C30H40Cl2N4 and molecular weight 526.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地喹氯铵
1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine dichloride
Also Known As: dequalinium chloride, Decamine, Dekamin, Dequalinium Dichloride, Dequafungan
| Molecular Formula | C30H40Cl2N4 |
|---|---|
| Molecular Weight | 526.26 g/mol |
| LogP | 0.18 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 526.263 |
| Heavy Atoms | 36 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 522-51-0 |
|---|---|
| SMILES | CC1=[N+](C2=CC=CC=C2C(=C1)N)CCCCCCCCCC[N+]3=C(C=C(C4=CC=CC=C43)N)C.[Cl-].[Cl-] |
| InChIKey | LTNZEXKYNRNOGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
地喹氯铵 (CAS 522-51-0), with molecular formula C30H40Cl2N4 and molecular weight 526.26 g/mol. IUPAC: 1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine dichloride.
Chemical Property Profile of 地喹氯铵
Property Insights of 地喹氯铵
The XLogP value of 0.18 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 地喹氯铵. With a topological polar surface area (TPSA) of 59.8 Ų, 地喹氯铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 地喹氯铵 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 地喹氯铵?
The CAS number of 地喹氯铵 is 522-51-0.
What is the molecular formula of 地喹氯铵?
The molecular formula of 地喹氯铵 is C30H40Cl2N4.
What is the molecular weight of 地喹氯铵?
The molecular weight of 地喹氯铵 is 526.26 g/mol.
Where can I buy 地喹氯铵?
You can request a quote for 地喹氯铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 地喹氯铵?
Yes, KEHONG BIO provides custom synthesis services for 地喹氯铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.