3H-1,2-Dithiole-3-thione, 4-methyl-
TL;DR: 3H-1,2-Dithiole-3-thione, 4-methyl- (CAS 3354-41-4) is a chemical compound with molecular formula C4H4S3 and molecular weight 147.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyldithiole-3-thione
Also Known As: 4-Methyl-trithion, 4-methyldithiole-3-thione, 3H-1,2-Dithiole-3-thione, 4-methyl-, 4-Methyl-3H-1,2-dithiole-3-thione, 4-methyl-1,2-dithiole-3-thione
| Molecular Formula | C4H4S3 |
|---|---|
| Molecular Weight | 147.95 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.94751 |
| Heavy Atoms | 7 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 3354-41-4 |
|---|---|
| SMILES | CC1=CSSC1=S |
| InChIKey | YHKZVQYBNUVXKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3H-1,2-Dithiole-3-thione, 4-methyl- (CAS 3354-41-4), with molecular formula C4H4S3 and molecular weight 147.95 g/mol. IUPAC: 4-methyldithiole-3-thione.
Chemical Property Profile of 3H-1,2-Dithiole-3-thione, 4-methyl-
Property Insights of 3H-1,2-Dithiole-3-thione, 4-methyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,2-Dithiole-3-thione, 4-methyl-. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-1,2-Dithiole-3-thione, 4-methyl-. Following Lipinski's Rule of Five, 3H-1,2-Dithiole-3-thione, 4-methyl- 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 3H-1,2-Dithiole-3-thione, 4-methyl-?
The CAS number of 3H-1,2-Dithiole-3-thione, 4-methyl- is 3354-41-4.
What is the molecular formula of 3H-1,2-Dithiole-3-thione, 4-methyl-?
The molecular formula of 3H-1,2-Dithiole-3-thione, 4-methyl- is C4H4S3.
What is the molecular weight of 3H-1,2-Dithiole-3-thione, 4-methyl-?
The molecular weight of 3H-1,2-Dithiole-3-thione, 4-methyl- is 147.95 g/mol.
Where can I buy 3H-1,2-Dithiole-3-thione, 4-methyl-?
You can request a quote for 3H-1,2-Dithiole-3-thione, 4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,2-Dithiole-3-thione, 4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2-Dithiole-3-thione, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.