(4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide
TL;DR: (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide (CAS 4727-49-5) is a chemical compound with molecular formula C23H23IN2 and molecular weight 454.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide
Also Known As: EINECS 225-223-2, 1,1'-Diethyl-4,4'-cyanine iodide, 1,1-DIETHYL-4,4-CYANINEIODIDE, 1-Ethyl-4-((1-ethyl-4(1H)-quinolylidene)methyl)quinolinium iodide, 1-ethyl-4-[(1-ethylquinolin-4-ylidene)methyl]quinolin-1-ium iodide
| Molecular Formula | C23H23IN2 |
|---|---|
| Molecular Weight | 454.09 g/mol |
| LogP | 2.0454 |
| Topological Polar Surface Area | 7.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.0906 |
| Heavy Atoms | 26 |
| Complexity | 988.4193 |
Chemical Identifiers
| CAS Number | 4727-49-5 |
|---|---|
| SMILES | CCN1C=C/C(=C/C2=CC=[N+](C3=CC=CC=C23)CC)/C4=CC=CC=C41.[I-] |
Product Overview
(4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide (CAS 4727-49-5), with molecular formula C23H23IN2 and molecular weight 454.09 g/mol. IUPAC: (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide.
Chemical Property Profile of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide
Property Insights of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide
The XLogP value of 2.0454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide. With a topological polar surface area (TPSA) of 7.12 Ų, (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide has 0 hydrogen bond donor(s) and 1 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 (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide?
The CAS number of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide is 4727-49-5.
What is the molecular formula of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide?
The molecular formula of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide is C23H23IN2.
What is the molecular weight of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide?
The molecular weight of (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide is 454.09 g/mol.
Where can I buy (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide?
You can request a quote for (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-1-ethyl-4-[(1-ethylquinolin-1-ium-4-yl)methylidene]quinoline iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.