![3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole structure](/static/products/5577/55770-77-9.webp)
3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 55770-77-9) is a chemical compound with molecular formula C5H6N4S3 and molecular weight 217.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-bis(methylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: NCIOpen2_007105, 3,6-bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3,6-bis(methylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole,3,6-bis(methylthio)-, 3,6-bis(methylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadia
| Molecular Formula | C5H6N4S3 |
|---|---|
| Molecular Weight | 217.98 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.97546 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 55770-77-9 |
|---|---|
| SMILES | CSC1=NN=C2N1N=C(S2)SC |
| InChIKey | UIQYUXNKVWDQQR-UHFFFAOYSA-N |
Product Overview
3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 55770-77-9), with molecular formula C5H6N4S3 and molecular weight 217.98 g/mol. IUPAC: 3,6-bis(methylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 hydrogen bond donor(s) and 6 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 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 55770-77-9.
What is the molecular formula of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C5H6N4S3.
What is the molecular weight of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 217.98 g/mol.
Where can I buy 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][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 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Bis(methylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.