Unithiol disulfide
TL;DR: Unithiol disulfide (CAS 115681-29-3) is a chemical compound with molecular formula C6H14O6S6 and molecular weight 373.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-sulfanyl-3-[(2-sulfanyl-3-sulfopropyl)disulfanyl]propane-1-sulfonic acid
Also Known As: Dmps disulfide, Unithiol disulfide, Unitiol disulfide, 1-Propanesulfonic acid, 3,3'-dithiobis(2-mercapto-, 2-sulfanyl-3-[(2-sulfanyl-3-sulfopropyl)disulfanyl]propane-1-sulfonic acid
| Molecular Formula | C6H14O6S6 |
|---|---|
| Molecular Weight | 373.91 g/mol |
| LogP | 0.7402 |
| Topological Polar Surface Area | 108.74 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 373.91147 |
| Heavy Atoms | 18 |
| Complexity | 387.48398 |
Chemical Identifiers
| CAS Number | 115681-29-3 |
|---|---|
| SMILES | C(C(CS(=O)(=O)O)S)SSCC(CS(=O)(=O)O)S |
Product Overview
Unithiol disulfide (CAS 115681-29-3), with molecular formula C6H14O6S6 and molecular weight 373.91 g/mol. IUPAC: 2-sulfanyl-3-[(2-sulfanyl-3-sulfopropyl)disulfanyl]propane-1-sulfonic acid.
Chemical Property Profile of Unithiol disulfide
Property Insights of Unithiol disulfide
The XLogP value of 0.7402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Unithiol disulfide. The TPSA of 108.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Unithiol disulfide. Following Lipinski's Rule of Five, Unithiol disulfide has 4 hydrogen bond donor(s) and 8 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 Unithiol disulfide?
The CAS number of Unithiol disulfide is 115681-29-3.
What is the molecular formula of Unithiol disulfide?
The molecular formula of Unithiol disulfide is C6H14O6S6.
What is the molecular weight of Unithiol disulfide?
The molecular weight of Unithiol disulfide is 373.91 g/mol.
Where can I buy Unithiol disulfide?
You can request a quote for Unithiol disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Unithiol disulfide?
Yes, KEHONG BIO provides custom synthesis services for Unithiol disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.