1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide
TL;DR: 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide (CAS 34597-54-1) is a chemical compound with molecular formula C5H4N2O4 and molecular weight 156.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxylic acid
Also Known As: 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide, Cid 3082401, 4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxylic acid, Pyrazinecarboxylic acid, 1,6-dihydro-6-oxo-, 4-oxide, 1,6-dihydro-6-oxo-2-pyrazinecarboxylicacid4-oxide
| Molecular Formula | C5H4N2O4 |
|---|---|
| Molecular Weight | 156.02 g/mol |
| LogP | -1.2935 |
| Topological Polar Surface Area | 97.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.0171 |
| Heavy Atoms | 11 |
| Complexity | 342.5808 |
Chemical Identifiers
| CAS Number | 34597-54-1 |
|---|---|
| SMILES | C1=C(NC(=O)C=[N+]1[O-])C(=O)O |
Product Overview
1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide (CAS 34597-54-1), with molecular formula C5H4N2O4 and molecular weight 156.02 g/mol. IUPAC: 4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxylic acid.
Chemical Property Profile of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide
Property Insights of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide
The XLogP value of -1.2935 indicates that 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide. Following Lipinski's Rule of Five, 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide has 2 hydrogen bond donor(s) and 3 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 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide?
The CAS number of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide is 34597-54-1.
What is the molecular formula of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide?
The molecular formula of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide is C5H4N2O4.
What is the molecular weight of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide?
The molecular weight of 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide is 156.02 g/mol.
Where can I buy 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide?
You can request a quote for 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Dihydro-6-oxo-2-pyrazinecarboxylic acid 4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.