2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole
TL;DR: 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole (CAS 7653-68-1) is a chemical compound with molecular formula C4H6N2O4S3 and molecular weight 241.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(methylsulfonyl)-1,3,4-thiadiazole
Also Known As: 2,5-bis(methylsulfonyl)-1,3,4-thiadiazole, dimethanesulfonyl-1,3,4-thiadiazole, 2,5-Di(methanesulfonyl)-1,3,4-thiadiazole, J2.087.877K, Tridecanoic acid,4-formyl-2-methoxyphenyl ester
| Molecular Formula | C4H6N2O4S3 |
|---|---|
| Molecular Weight | 241.95 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.94897 |
| Heavy Atoms | 13 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 7653-68-1 |
|---|---|
| SMILES | CS(=O)(=O)C1=NN=C(S1)S(=O)(=O)C |
| InChIKey | NMRDWXDZQQIHQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole (CAS 7653-68-1), with molecular formula C4H6N2O4S3 and molecular weight 241.95 g/mol. IUPAC: 2,5-bis(methylsulfonyl)-1,3,4-thiadiazole.
Chemical Property Profile of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole
Property Insights of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole
The XLogP value of -0.5 indicates that 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole. Following Lipinski's Rule of Five, 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole has 0 hydrogen bond donor(s) and 7 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 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole?
The CAS number of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole is 7653-68-1.
What is the molecular formula of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole?
The molecular formula of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole is C4H6N2O4S3.
What is the molecular weight of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole?
The molecular weight of 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole is 241.95 g/mol.
Where can I buy 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole?
You can request a quote for 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(methylsulfonyl)-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.