1,2,4-Trithiapentane
TL;DR: 1,2,4-Trithiapentane (CAS 105633-23-6) is a chemical compound with molecular formula C2H6S3 and molecular weight 125.963165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disulfanyl(methylsulfanyl)methane
Also Known As: 1,2,4-trithiapentane, disulfanyl(methylsulfanyl)methane, Methanesulfenothioic acid, (methylthio)-, (METHYLSULFANYL)METHANEDITHIOPEROXOL
Technical Specifications
| Molecular Formula | C2H6S3 |
| Molecular Weight | 125.963165 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.963165 Da |
| Heavy Atoms | 5 |
| Complexity | 14.0 |
| SMILES | CSCSS |
| InChIKey | WALSYGWNKQSQFW-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,4-Trithiapentane
Property Insights of 1,2,4-Trithiapentane
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Trithiapentane. With a topological polar surface area (TPSA) of 51.6 Ų, 1,2,4-Trithiapentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Trithiapentane has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,4-Trithiapentane?
The CAS number of 1,2,4-Trithiapentane is 105633-23-6.
What is the molecular formula of 1,2,4-Trithiapentane?
The molecular formula of 1,2,4-Trithiapentane is C2H6S3.
What is the molecular weight of 1,2,4-Trithiapentane?
The molecular weight of 1,2,4-Trithiapentane is 125.963165 g/mol.
Where can I buy 1,2,4-Trithiapentane?
You can request a quote for 1,2,4-Trithiapentane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,4-Trithiapentane?
Yes, CoreyChem provides custom synthesis services for 1,2,4-Trithiapentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.