1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-
TL;DR: 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- (CAS 73984-93-7) is a chemical compound with molecular formula C14H26N2S4 and molecular weight 350.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methylundecan-2-yldisulfanyl)-3H-1,3,4-thiadiazole-2-thione
Also Known As: 1,3,4-Thiadiazole-2 -thione,5- -, 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-, J2.085.179A, 5-(1,1-Dimethyldecyldithio)-1,3,4-thiadiazole-2-thiol, 5-(2-methylundecan-2-yldisulfanyl)-3H-1,3,4-thiadiazole-2-thione
| Molecular Formula | C14H26N2S4 |
|---|---|
| Molecular Weight | 350.10 g/mol |
| LogP | 6.86029 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 350.09787 |
| Heavy Atoms | 20 |
| Complexity | 411.30646 |
Chemical Identifiers
| CAS Number | 73984-93-7 |
|---|---|
| SMILES | CCCCCCCCCC(C)(C)SSC1=NNC(=S)S1 |
Product Overview
1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- (CAS 73984-93-7), with molecular formula C14H26N2S4 and molecular weight 350.10 g/mol. IUPAC: 5-(2-methylundecan-2-yldisulfanyl)-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-
Property Insights of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-
The XLogP value of 6.86029 indicates that 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-?
The CAS number of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- is 73984-93-7.
What is the molecular formula of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-?
The molecular formula of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- is C14H26N2S4.
What is the molecular weight of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-?
The molecular weight of 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- is 350.10 g/mol.
Where can I buy 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-?
You can request a quote for 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.