Purine-2,6-dione
TL;DR: Purine-2,6-dione (CAS 51953-26-5) is a chemical compound with molecular formula C5H2N4O2 and molecular weight 150.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
purine-2,6-dione
Also Known As: xanthine, 1H-purine-2,6-dione, purine-2,6-dione, 2,6-dioxopurine, 2,6-Dihydroxypurine
| Molecular Formula | C5H2N4O2 |
|---|---|
| Molecular Weight | 150.02 g/mol |
| LogP | -0.8824 |
| Topological Polar Surface Area | 83.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.01778 |
| Heavy Atoms | 11 |
| Complexity | 338.39157 |
Chemical Identifiers
| CAS Number | 51953-26-5 |
|---|---|
| SMILES | C1=NC2=NC(=O)NC(=O)C2=N1 |
Product Overview
Purine-2,6-dione (CAS 51953-26-5), with molecular formula C5H2N4O2 and molecular weight 150.02 g/mol. IUPAC: purine-2,6-dione.
Chemical Property Profile of Purine-2,6-dione
Property Insights of Purine-2,6-dione
The XLogP value of -0.8824 indicates that Purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Purine-2,6-dione. Following Lipinski's Rule of Five, Purine-2,6-dione has 1 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 Purine-2,6-dione?
The CAS number of Purine-2,6-dione is 51953-26-5.
What is the molecular formula of Purine-2,6-dione?
The molecular formula of Purine-2,6-dione is C5H2N4O2.
What is the molecular weight of Purine-2,6-dione?
The molecular weight of Purine-2,6-dione is 150.02 g/mol.
Where can I buy Purine-2,6-dione?
You can request a quote for Purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for Purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.