1,3-Bis(methylthio)-2-methoxypropane
TL;DR: 1,3-Bis(methylthio)-2-methoxypropane (CAS 31805-84-2) is a chemical compound with molecular formula C6H14OS2 and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-1,3-bis(methylsulfanyl)propane
Also Known As: 1,3-Bis(methylthio)-2-methoxypropane, 2-Methoxy-1,3-bis(methylsulfanyl)propane, 2-Methoxy-1,3-bis(methylthio)propane, 2-Acetamido-5-picoline, EINECS 250-815-2
| Molecular Formula | C6H14OS2 |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 166.04861 |
| Heavy Atoms | 9 |
| Complexity | 53.0 |
Chemical Identifiers
| CAS Number | 31805-84-2 |
|---|---|
| SMILES | COC(CSC)CSC |
| InChIKey | MOISORXUYSHXRU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Bis(methylthio)-2-methoxypropane (CAS 31805-84-2), with molecular formula C6H14OS2 and molecular weight 166.05 g/mol. IUPAC: 2-methoxy-1,3-bis(methylsulfanyl)propane.
Chemical Property Profile of 1,3-Bis(methylthio)-2-methoxypropane
Property Insights of 1,3-Bis(methylthio)-2-methoxypropane
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis(methylthio)-2-methoxypropane. With a topological polar surface area (TPSA) of 59.8 Ų, 1,3-Bis(methylthio)-2-methoxypropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(methylthio)-2-methoxypropane has 0 hydrogen bond donor(s) and 3 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 1,3-Bis(methylthio)-2-methoxypropane?
The CAS number of 1,3-Bis(methylthio)-2-methoxypropane is 31805-84-2.
What is the molecular formula of 1,3-Bis(methylthio)-2-methoxypropane?
The molecular formula of 1,3-Bis(methylthio)-2-methoxypropane is C6H14OS2.
What is the molecular weight of 1,3-Bis(methylthio)-2-methoxypropane?
The molecular weight of 1,3-Bis(methylthio)-2-methoxypropane is 166.05 g/mol.
Where can I buy 1,3-Bis(methylthio)-2-methoxypropane?
You can request a quote for 1,3-Bis(methylthio)-2-methoxypropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(methylthio)-2-methoxypropane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(methylthio)-2-methoxypropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.