Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)
TL;DR: Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) (CAS 50745-64-7) is a chemical compound with molecular formula C13H16INS and molecular weight 345.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-ethylsulfanylquinolin-1-ium iodide
Also Known As: Quinolinium, 1-ethyl-2-(ethylthio)-, iodide, 1-ethyl-2-ethylsulfanylquinolin-1-ium;iodide, Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1), 1-ethyl-2-(ethylthio)quinolinium iodide, 1-ethyl-2-(ethylthio)-Quinolinium, iodide
| Molecular Formula | C13H16INS |
|---|---|
| Molecular Weight | 345.00 g/mol |
| LogP | 0.2632 |
| Topological Polar Surface Area | 3.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.00482 |
| Heavy Atoms | 16 |
| Complexity | 470.4393 |
Chemical Identifiers
| CAS Number | 50745-64-7 |
|---|---|
| SMILES | CC[N+]1=C(C=CC2=CC=CC=C21)SCC.[I-] |
Product Overview
Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) (CAS 50745-64-7), with molecular formula C13H16INS and molecular weight 345.00 g/mol. IUPAC: 1-ethyl-2-ethylsulfanylquinolin-1-ium iodide.
Chemical Property Profile of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)
Property Insights of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)
The XLogP value of 0.2632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1). With a topological polar surface area (TPSA) of 3.88 Ų, Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) 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 Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)?
The CAS number of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) is 50745-64-7.
What is the molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)?
The molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) is C13H16INS.
What is the molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)?
The molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) is 345.00 g/mol.
Where can I buy Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1)?
You can request a quote for Quinolinium, 1-ethyl-2-(ethylthio)-, 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)-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 1-ethyl-2-(ethylthio)-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.