5-N-Methyloxaluric acid
TL;DR: 5-N-Methyloxaluric acid (CAS 89281-42-5) is a chemical compound with molecular formula C4H6N2O4 and molecular weight 146.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methylcarbamoylamino)-2-oxoacetic acid
Also Known As: 5-N-Methyloxaluric acid, methylcarbamoyl-oxalamic acid, N-(Methylcarbamoyl)oxamidic acid, 2-(methylcarbamoylamino)-2-oxoacetic acid, 2-[(methylcarbamoyl)amino]-2-oxoacetic acid
| Molecular Formula | C4H6N2O4 |
|---|---|
| Molecular Weight | 146.03 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.03276 |
| Heavy Atoms | 10 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 89281-42-5 |
|---|---|
| SMILES | CNC(=O)NC(=O)C(=O)O |
| InChIKey | APOPSBQCJFDMQQ-UHFFFAOYSA-N |
Product Overview
5-N-Methyloxaluric acid (CAS 89281-42-5), with molecular formula C4H6N2O4 and molecular weight 146.03 g/mol. IUPAC: 2-(methylcarbamoylamino)-2-oxoacetic acid.
Chemical Property Profile of 5-N-Methyloxaluric acid
Property Insights of 5-N-Methyloxaluric acid
The XLogP value of -0.3 indicates that 5-N-Methyloxaluric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-N-Methyloxaluric acid. Following Lipinski's Rule of Five, 5-N-Methyloxaluric acid has 3 hydrogen bond donor(s) and 4 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 5-N-Methyloxaluric acid?
The CAS number of 5-N-Methyloxaluric acid is 89281-42-5.
What is the molecular formula of 5-N-Methyloxaluric acid?
The molecular formula of 5-N-Methyloxaluric acid is C4H6N2O4.
What is the molecular weight of 5-N-Methyloxaluric acid?
The molecular weight of 5-N-Methyloxaluric acid is 146.03 g/mol.
Where can I buy 5-N-Methyloxaluric acid?
You can request a quote for 5-N-Methyloxaluric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-N-Methyloxaluric acid?
Yes, KEHONG BIO provides custom synthesis services for 5-N-Methyloxaluric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.