Aurothiomalate
TL;DR: Aurothiomalate (CAS 4846-27-9) is a chemical compound with molecular formula C4H5AuO4S and molecular weight 345.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroxy-1,4-dioxobutane-2-thiolate;gold(1+)
Also Known As: Aurothiomalate, Myocrisin, aurothiomalic acid, AuTM, Sodium aurothiomalate
| Molecular Formula | C4H5AuO4S |
|---|---|
| Molecular Weight | 345.96 g/mol |
| LogP | -0.5413 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.95743 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 4846-27-9 |
|---|---|
| SMILES | C(C(C(=O)O)[S-])C(=O)O.[Au+] |
| InChIKey | XJHSMFDIQHVMCY-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aurothiomalate (CAS 4846-27-9), with molecular formula C4H5AuO4S and molecular weight 345.96 g/mol. IUPAC: 1,4-dihydroxy-1,4-dioxobutane-2-thiolate;gold(1+).
Chemical Property Profile of Aurothiomalate
Property Insights of Aurothiomalate
The XLogP value of -0.5413 indicates that Aurothiomalate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Aurothiomalate. Following Lipinski's Rule of Five, Aurothiomalate has 2 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 Aurothiomalate?
The CAS number of Aurothiomalate is 4846-27-9.
What is the molecular formula of Aurothiomalate?
The molecular formula of Aurothiomalate is C4H5AuO4S.
What is the molecular weight of Aurothiomalate?
The molecular weight of Aurothiomalate is 345.96 g/mol.
Where can I buy Aurothiomalate?
You can request a quote for Aurothiomalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aurothiomalate?
Yes, KEHONG BIO provides custom synthesis services for Aurothiomalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.