Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate
TL;DR: Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate (CAS 337310-73-3) is a chemical compound with molecular formula C16H14N2O5S and molecular weight 346.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate
Also Known As: ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate, ethyl {[4-oxido-2-oxo-3-(thiophen-2-yl)quinoxalin-1(2H)-yl]oxy}acetate, 2-[(4-oxido-2-oxo-3-thiophen-2-yl-1-quinoxalin-4-iumyl)oxy]acetic acid ethyl ester, 2-[2-keto-4-oxido-3-(2-thienyl)quinoxalin-4-ium-1-yl]oxyacetic acid ethyl ester, 4-(2-ethoxy-2-oxoethoxy)-3-oxo-2-(thiophen-2-yl)-3,4-dihydroquinoxaline 1-oxide
| Molecular Formula | C16H14N2O5S |
|---|---|
| Molecular Weight | 346.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.06235 |
| Heavy Atoms | 24 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 337310-73-3 |
|---|---|
| SMILES | CCOC(=O)CON1C2=CC=CC=C2[N+](=C(C1=O)C3=CC=CS3)[O-] |
| InChIKey | VUHZMDBVQNBNIK-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate (CAS 337310-73-3), with molecular formula C16H14N2O5S and molecular weight 346.06 g/mol. IUPAC: ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate.
Chemical Property Profile of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate
Property Insights of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate 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 Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate?
The CAS number of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate is 337310-73-3.
What is the molecular formula of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate?
The molecular formula of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate is C16H14N2O5S.
What is the molecular weight of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate?
The molecular weight of Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate is 346.06 g/mol.
Where can I buy Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate?
You can request a quote for Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(4-oxido-2-oxo-3-thiophen-2-ylquinoxalin-4-ium-1-yl)oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.