Probucol
TL;DR: Probucol (CAS 23288-49-5) is a chemical compound with molecular formula C31H48O2S2 and molecular weight 516.3096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol
Also Known As: probucol, Lorelco, Bisphenabid, Biphenabid, Lurselle
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C31H48O2S2 |
| Molecular Weight | 516.3096 g/mol |
| XLogP | 11.3 |
| Topological Polar Surface Area (TPSA) | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.3096 Da |
| Heavy Atoms | 35 |
| Complexity | 583.0 |
| Melting Point | 125 |
| Solubility | 4.18e-05 g/L |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C |
| InChIKey | FYPMFJGVHOHGLL-UHFFFAOYSA-N |
Product Description
Applications: Probucol 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).
A pharmaceutical intermediate supplied by CoreyChem, Probucol (CAS 23288-49-5) has the molecular formula C31H48O2S2 and a molecular weight of 516.31 g/mol. Reported properties include a solubility: 4.18e-05 g/L. Synonyms include probucol and Lorelco.
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 Probucol
Property Insights of Probucol
The XLogP value of 11.3 indicates that Probucol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Probucol. Following Lipinski's Rule of Five, Probucol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Probucol?
The CAS number of Probucol is 23288-49-5.
What is the molecular formula of Probucol?
The molecular formula of Probucol is C31H48O2S2.
What is the molecular weight of Probucol?
The molecular weight of Probucol is 516.3096 g/mol.
What are the applications of Probucol?
Probucol 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 Probucol?
You can request a quote for Probucol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Probucol?
Yes, CoreyChem provides custom synthesis services for Probucol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.