Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate
TL;DR: Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate (CAS 63680-76-2) is a chemical compound with molecular formula C14H18N2O6S and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylquinolin-1-ium-8-yl) N,N-dimethylcarbamate;methyl sulfate
Also Known As: Dimethylcarbamic ester of 8-oxymethylquinolinium methylsulfate, Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate, Carbamic acid, N,N-dimethyl-, 8-quinolinyl ester, methosulfate, Quinolinium, 8-hydroxy-1-methyl-, methylsulfate, dimethylcarbamate, 8-[(dimethylcarbamoyl)oxy]-1-methylquinolinium methyl sulfate
| Molecular Formula | C14H18N2O6S |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 0.82 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.08856 |
| Heavy Atoms | 23 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 63680-76-2 |
|---|---|
| SMILES | C[N+]1=CC=CC2=C1C(=CC=C2)OC(=O)N(C)C.COS(=O)(=O)[O-] |
| InChIKey | WWXJZOYNTTWUAI-UHFFFAOYSA-M |
Product Overview
Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate (CAS 63680-76-2), with molecular formula C14H18N2O6S and molecular weight 342.09 g/mol. IUPAC: (1-methylquinolin-1-ium-8-yl) N,N-dimethylcarbamate;methyl sulfate.
Chemical Property Profile of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate
Property Insights of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate
The XLogP value of 0.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate. Following Lipinski's Rule of Five, Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate has 0 hydrogen bond donor(s) and 6 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, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate?
The CAS number of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate is 63680-76-2.
What is the molecular formula of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate?
The molecular formula of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate is C14H18N2O6S.
What is the molecular weight of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate?
The molecular weight of Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate is 342.09 g/mol.
Where can I buy Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate?
You can request a quote for Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 8-(N',N'-dimethylcarbamoyloxy)-1-methyl-, methylsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.