Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)
TL;DR: Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) (CAS 63816-13-7) is a chemical compound with molecular formula C14H18INOS and molecular weight 375.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-ethylsulfanyl-6-methoxyquinolin-1-ium iodide
Also Known As: 1-Ethyl-2-(ethylthio)-6-methoxyquinolinium iodide, Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1), 1-ethyl-2-ethylsulfanyl-6-methoxyquinolin-1-ium;iodide, Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide, 1-ETHYL-2-ETHYLTHIO-6-METHOXYQUINOLINIUM IODIDE
| Molecular Formula | C14H18INOS |
|---|---|
| Molecular Weight | 375.02 g/mol |
| LogP | 0.27 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.01538 |
| Heavy Atoms | 18 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 63816-13-7 |
|---|---|
| SMILES | CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)SCC.[I-] |
| InChIKey | NVYHFXSCBIFCJF-UHFFFAOYSA-M |
Product Overview
Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) (CAS 63816-13-7), with molecular formula C14H18INOS and molecular weight 375.02 g/mol. IUPAC: 1-ethyl-2-ethylsulfanyl-6-methoxyquinolin-1-ium iodide.
Chemical Property Profile of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)
Property Insights of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)
The XLogP value of 0.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1). With a topological polar surface area (TPSA) of 38.4 Ų, Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, 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-methoxy-, iodide (1:1) has 0 hydrogen bond donor(s) and 3 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-methoxy-, iodide (1:1)?
The CAS number of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) is 63816-13-7.
What is the molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)?
The molecular formula of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) is C14H18INOS.
What is the molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)?
The molecular weight of Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) is 375.02 g/mol.
Where can I buy Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1)?
You can request a quote for Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, 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-methoxy-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 1-ethyl-2-(ethylthio)-6-methoxy-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.