1,2,3-Trithiolane
TL;DR: 1,2,3-Trithiolane (CAS 6669-39-2) is a chemical compound with molecular formula C2H4S3 and molecular weight 123.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trithiolane
Also Known As: trithiolane, Trithiolan, 1,2,3-Trithiolane, [1,2,3]Trithiolane, (1,2,3)Trithiolane
| Molecular Formula | C2H4S3 |
|---|---|
| Molecular Weight | 123.95 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 123.94752 |
| Heavy Atoms | 5 |
| Complexity | 24.0 |
Chemical Identifiers
| CAS Number | 6669-39-2 |
|---|---|
| SMILES | C1CSSS1 |
| InChIKey | LTTGPXZEANXUSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3-Trithiolane (CAS 6669-39-2), with molecular formula C2H4S3 and molecular weight 123.95 g/mol. IUPAC: trithiolane.
Chemical Property Profile of 1,2,3-Trithiolane
Property Insights of 1,2,3-Trithiolane
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Trithiolane. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Trithiolane. Following Lipinski's Rule of Five, 1,2,3-Trithiolane 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 1,2,3-Trithiolane?
The CAS number of 1,2,3-Trithiolane is 6669-39-2.
What is the molecular formula of 1,2,3-Trithiolane?
The molecular formula of 1,2,3-Trithiolane is C2H4S3.
What is the molecular weight of 1,2,3-Trithiolane?
The molecular weight of 1,2,3-Trithiolane is 123.95 g/mol.
Where can I buy 1,2,3-Trithiolane?
You can request a quote for 1,2,3-Trithiolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Trithiolane?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Trithiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.