2,5-Bis(dodecyldithio)-1,3,4-thiadiazole
TL;DR: 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole (CAS 13539-12-3) is a chemical compound with molecular formula C26H50N2S5 and molecular weight 550.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(dodecyldisulfanyl)-1,3,4-thiadiazole
Also Known As: 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole, 2,5-bis(dodecyldisulfanyl)-1,3,4-thiadiazole, 1,3,4-Thiadiazole,2,5-bis(dodecyldithio)-, 1,3,4-thiadiazole, 2,5-bis(dodecyldithio)-, BIS(DODECYLDISULFANYL)-1,3,4-THIADIAZOLE
| Molecular Formula | C26H50N2S5 |
|---|---|
| Molecular Weight | 550.26 g/mol |
| LogP | 13.3 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 26 |
| Exact Mass | 550.25775 |
| Heavy Atoms | 33 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 13539-12-3 |
|---|---|
| SMILES | CCCCCCCCCCCCSSC1=NN=C(S1)SSCCCCCCCCCCCC |
| InChIKey | ZBADMMCYTSORHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Bis(dodecyldithio)-1,3,4-thiadiazole (CAS 13539-12-3), with molecular formula C26H50N2S5 and molecular weight 550.26 g/mol. IUPAC: 2,5-bis(dodecyldisulfanyl)-1,3,4-thiadiazole.
Chemical Property Profile of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole
Property Insights of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole
The XLogP value of 13.3 indicates that 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole?
The CAS number of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole is 13539-12-3.
What is the molecular formula of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole?
The molecular formula of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole is C26H50N2S5.
What is the molecular weight of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole?
The molecular weight of 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole is 550.26 g/mol.
Where can I buy 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole?
You can request a quote for 2,5-Bis(dodecyldithio)-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(dodecyldithio)-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(dodecyldithio)-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.