6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid
TL;DR: 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid (CAS 7250-57-9) is a chemical compound with molecular formula C5H3ClN4O4S and molecular weight 249.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid
Also Known As: 6-chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid, 6-chloro-8-oxo-8,9-dihydro-7H-purine-2-sulfonic acid, 6-chloro-8-hydroxy-9H-purine-2-sulfonic acid, 6-chlor-8-hydroxy-9H-purin-2-sulfonsäure, I14-23871
| Molecular Formula | C5H3ClN4O4S |
|---|---|
| Molecular Weight | 249.96 g/mol |
| LogP | -0.4537 |
| Topological Polar Surface Area | 128.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.95636 |
| Heavy Atoms | 15 |
| Complexity | 686.6102 |
Chemical Identifiers
| CAS Number | 7250-57-9 |
|---|---|
| SMILES | C12=C(NC(=O)N1)N=C(N=C2Cl)S(=O)(=O)O |
Product Overview
6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid (CAS 7250-57-9), with molecular formula C5H3ClN4O4S and molecular weight 249.96 g/mol. IUPAC: 6-chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid.
Chemical Property Profile of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid
Property Insights of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid
The XLogP value of -0.4537 indicates that 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid. Following Lipinski's Rule of Five, 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid has 3 hydrogen bond donor(s) and 5 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 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid?
The CAS number of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid is 7250-57-9.
What is the molecular formula of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid?
The molecular formula of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid is C5H3ClN4O4S.
What is the molecular weight of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid?
The molecular weight of 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid is 249.96 g/mol.
Where can I buy 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid?
You can request a quote for 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-8-oxo-7,9-dihydropurine-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.