Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate
TL;DR: Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate (CAS 384367-93-5) is a chemical compound with molecular formula C18H15N3O7 and molecular weight 385.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate
Also Known As: ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate, ethyl {[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-1(2H)-yl]oxy}acetate, 4-(2-ethoxy-2-oxoethoxy)-2-(3-nitrophenyl)-3-oxo-3,4-dihydroquinoxaline 1-oxide
| Molecular Formula | C18H15N3O7 |
|---|---|
| Molecular Weight | 385.09 g/mol |
| LogP | 1.2018 |
| Topological Polar Surface Area | 127.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.091 |
| Heavy Atoms | 28 |
| Complexity | 1123.8525 |
Chemical Identifiers
| CAS Number | 384367-93-5 |
|---|---|
| SMILES | CCOC(=O)CON1C2=CC=CC=C2[N+](=C(C1=O)C3=CC(=CC=C3)[N+](=O)[O-])[O-] |
Product Overview
Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate (CAS 384367-93-5), with molecular formula C18H15N3O7 and molecular weight 385.09 g/mol. IUPAC: ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate.
Chemical Property Profile of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate
Property Insights of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate
The XLogP value of 1.2018 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate. The TPSA of 127.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate has 0 hydrogen bond donor(s) and 7 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-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate?
The CAS number of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate is 384367-93-5.
What is the molecular formula of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate?
The molecular formula of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate is C18H15N3O7.
What is the molecular weight of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate?
The molecular weight of Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate is 385.09 g/mol.
Where can I buy Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate?
You can request a quote for Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-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-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[3-(3-nitrophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.