碘地喹铵
TL;DR: 碘地喹铵 (CAS 2019-42-3) is a chemical compound with molecular formula C30H40I2N4 and molecular weight 710.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
碘地喹铵
1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine diiodide
Also Known As: Dequalinium iodide, dequalinium, Dequalinium Diiodide, DEQUALINIUMIODIDE, starbld0009561
| Molecular Formula | C30H40I2N4 |
|---|---|
| Molecular Weight | 710.13 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 | 710.1342 |
| Heavy Atoms | 36 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 2019-42-3 |
|---|---|
| SMILES | CC1=[N+](C2=CC=CC=C2C(=C1)N)CCCCCCCCCC[N+]3=C(C=C(C4=CC=CC=C43)N)C.[I-].[I-] |
| InChIKey | BTXPITUAZUILEM-UHFFFAOYSA-N |
Product Overview
碘地喹铵 (CAS 2019-42-3), with molecular formula C30H40I2N4 and molecular weight 710.13 g/mol. IUPAC: 1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine diiodide.
Chemical Property Profile of 碘地喹铵
Property Insights of 碘地喹铵
The XLogP value of 0.18 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 碘地喹铵. With a topological polar surface area (TPSA) of 59.8 Ų, 碘地喹铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 碘地喹铵 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 碘地喹铵?
The CAS number of 碘地喹铵 is 2019-42-3.
What is the molecular formula of 碘地喹铵?
The molecular formula of 碘地喹铵 is C30H40I2N4.
What is the molecular weight of 碘地喹铵?
The molecular weight of 碘地喹铵 is 710.13 g/mol.
Where can I buy 碘地喹铵?
You can request a quote for 碘地喹铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 碘地喹铵?
Yes, KEHONG BIO provides custom synthesis services for 碘地喹铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.