ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate
TL;DR: ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate (CAS 332850-05-2) is a chemical compound with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-methyl-4-oxido-2-oxoquinoxalin-4-ium-1-yl)oxyacetate
Also Known As: ChemDiv1_005712, BAS 01838382, (3-Methyl-2-oxo-4-oxy-2H-quinoxalin-1-yloxy)-acetic acid ethyl ester, 4-(2-ethoxy-2-oxoethoxy)-2-methyl-3-oxo-3,4-dihydroquinoxaline 1-oxide, ethyl 2-(4-hydroxy-3-methyl-2-oxohydroquinoxalinyloxy)acetate
| Molecular Formula | C13H14N2O5 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.09027 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 332850-05-2 |
|---|---|
| SMILES | CCOC(=O)CON1C2=CC=CC=C2[N+](=C(C1=O)C)[O-] |
| InChIKey | DEEHPTWIVNRPBG-UHFFFAOYSA-N |
Product Overview
ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate (CAS 332850-05-2), with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol. IUPAC: ethyl 2-(3-methyl-4-oxido-2-oxoquinoxalin-4-ium-1-yl)oxyacetate.
Chemical Property Profile of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate
Property Insights of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate. Following Lipinski's Rule of Five, ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate has 0 hydrogen bond donor(s) and 5 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 [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate?
The CAS number of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate is 332850-05-2.
What is the molecular formula of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate?
The molecular formula of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate is C13H14N2O5.
What is the molecular weight of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate?
The molecular weight of ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate is 278.09 g/mol.
Where can I buy ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate?
You can request a quote for ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl [(3-methyl-4-oxido-2-oxoquinoxalin-1(2H)-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.