7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid
TL;DR: 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid (CAS 310-71-4) is a chemical compound with molecular formula C9H5N3O5 and molecular weight 235.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid
Also Known As: 7-nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid, 7-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid, 7-nitro-3-oxo-3,4-dihydro-quinoxaline-2-carboxylic acid, 2-Quinoxalinecarboxylic acid, 3,4-dihydro-7-nitro-3-oxo-, 2-Quinoxalinecarboxylicacid, 3,4-dihydro-7-nitro-3-oxo-
| Molecular Formula | C9H5N3O5 |
|---|---|
| Molecular Weight | 235.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.02292 |
| Heavy Atoms | 17 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 310-71-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])N=C(C(=O)N2)C(=O)O |
| InChIKey | OWAUKGQRJRKCTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid (CAS 310-71-4), with molecular formula C9H5N3O5 and molecular weight 235.02 g/mol. IUPAC: 7-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid.
Chemical Property Profile of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid
Property Insights of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid. Following Lipinski's Rule of Five, 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid has 2 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 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid?
The CAS number of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid is 310-71-4.
What is the molecular formula of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid?
The molecular formula of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid is C9H5N3O5.
What is the molecular weight of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid?
The molecular weight of 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid is 235.02 g/mol.
Where can I buy 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid?
You can request a quote for 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-Nitro-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.