Sulfoxone
TL;DR: Sulfoxone (CAS 144-76-3) is a chemical compound with molecular formula C14H16N2O6S3 and molecular weight 404.01706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[4-(sulfinomethylamino)phenyl]sulfonylanilino]methanesulfinic acid
Also Known As: sulfoxone, Aldesulfone, Aldesulphone, Sodium sulfoxone, Aldapsone
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H16N2O6S3 |
| Molecular Weight | 404.01706 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 404.01706 Da |
| Heavy Atoms | 25 |
| Complexity | 520.0 |
| Solubility | 2.63e+00 g/L |
| SMILES | C1=CC(=CC=C1NCS(=O)O)S(=O)(=O)C2=CC=C(C=C2)NCS(=O)O |
| InChIKey | NEDPPCHNEOMTJV-UHFFFAOYSA-N |
Product Description
Applications: Sulfoxone is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Sulfoxone (CAS 144-76-3) is a pharmaceutical intermediate with the molecular formula C14H16N2O6S3 and a molecular weight of 404.02 g/mol. Key physical properties include a solubility: 2.63e+00 g/L. Synonyms include sulfoxone and Aldesulfone.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Sulfoxone
Property Insights of Sulfoxone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfoxone. The TPSA of 180.0 Ų indicates high polarity, suggesting Sulfoxone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfoxone has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Sulfoxone?
The CAS number of Sulfoxone is 144-76-3.
What is the molecular formula of Sulfoxone?
The molecular formula of Sulfoxone is C14H16N2O6S3.
What is the molecular weight of Sulfoxone?
The molecular weight of Sulfoxone is 404.01706 g/mol.
What are the applications of Sulfoxone?
Sulfoxone is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Sulfoxone?
You can request a quote for Sulfoxone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sulfoxone?
Yes, CoreyChem provides custom synthesis services for Sulfoxone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.