Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)
TL;DR: Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) (CAS 57218-68-5) is a chemical compound with molecular formula C14H18INS and molecular weight 359.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-ethylsulfanyl-6-methylquinolin-1-ium iodide
Also Known As: Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide, 1-ethyl-2-(ethylsulfanyl)-6-methylquinolinium iodide, Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1), 1-Ethyl-2-(ethylthio)-6-methyl-quinolinium iodide, 1-ethyl-2-ethylsulfanyl-6-methylquinolin-1-ium iodide
| Molecular Formula | C14H18INS |
|---|---|
| Molecular Weight | 359.02 g/mol |
| LogP | 0.57 |
| Topological Polar Surface Area | 29.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.02048 |
| Heavy Atoms | 17 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 57218-68-5 |
|---|---|
| SMILES | CC[N+]1=C(C=CC2=C1C=CC(=C2)C)SCC.[I-] |
| InChIKey | HFLKGEMADXBUGB-UHFFFAOYSA-M |
Product Overview
Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) (CAS 57218-68-5), with molecular formula C14H18INS and molecular weight 359.02 g/mol. IUPAC: 1-ethyl-2-ethylsulfanyl-6-methylquinolin-1-ium iodide.
Chemical Property Profile of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)
Property Insights of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)
The XLogP value of 0.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1). With a topological polar surface area (TPSA) of 29.2 Ų, Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) 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 Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)?
The CAS number of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) is 57218-68-5.
What is the molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)?
The molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) is C14H18INS.
What is the molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)?
The molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) is 359.02 g/mol.
Where can I buy Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)?
You can request a quote for Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.