DICYANINE A
TL;DR: DICYANINE A (CAS 20591-23-5) is a chemical compound with molecular formula C25H25IN2 and molecular weight 480.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-[3-(1-ethylquinolin-1-ium-4-yl)prop-2-enylidene]quinoline iodide
Also Known As: DICYANINE A, Dicyanine A, 98%, Quinolinium, 1-ethyl-2-[3-(1-ethyl-4(1H)-quinolinylidene)-1-propenyl]-, iodide, 1-ethyl-2-[3-(1-ethylquinolin-1-ium-4-yl)prop-2-enylidene]quinoline;iodide, Quinolinium, 1-ethyl-2-(3-(1-ethyl-4(1H)-quinolinylidene)-1-propen-1-yl)-, iodide (1:1)
| Molecular Formula | C25H25IN2 |
|---|---|
| Molecular Weight | 480.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 7.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 480.10626 |
| Heavy Atoms | 28 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 20591-23-5 |
|---|---|
| SMILES | CCN1C(=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)C=CC4=CC=CC=C41.[I-] |
| InChIKey | AIUPVZRNWAATQJ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DICYANINE A (CAS 20591-23-5), with molecular formula C25H25IN2 and molecular weight 480.11 g/mol. IUPAC: 1-ethyl-2-[3-(1-ethylquinolin-1-ium-4-yl)prop-2-enylidene]quinoline iodide.
Chemical Property Profile of DICYANINE A
Property Insights of DICYANINE A
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DICYANINE A. With a topological polar surface area (TPSA) of 7.1 Ų, DICYANINE A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, DICYANINE A has 0 hydrogen bond donor(s) and 2 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 DICYANINE A?
The CAS number of DICYANINE A is 20591-23-5.
What is the molecular formula of DICYANINE A?
The molecular formula of DICYANINE A is C25H25IN2.
What is the molecular weight of DICYANINE A?
The molecular weight of DICYANINE A is 480.11 g/mol.
Where can I buy DICYANINE A?
You can request a quote for DICYANINE A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DICYANINE A?
Yes, KEHONG BIO provides custom synthesis services for DICYANINE A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.