![2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile structure](/static/products/3390/339029-89-9.webp)
2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
TL;DR: 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile (CAS 339029-89-9) is a chemical compound with molecular formula C7H5N5S and molecular weight 191.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Also Known As: 2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile, 2-(methylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile, 2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile, 2-(Methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
| Molecular Formula | C7H5N5S |
|---|---|
| Molecular Weight | 191.03 g/mol |
| LogP | 0.71788 |
| Topological Polar Surface Area | 66.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.02657 |
| Heavy Atoms | 13 |
| Complexity | 483.07883 |
Chemical Identifiers
| CAS Number | 339029-89-9 |
|---|---|
| SMILES | CSC1=NN2C=C(C=NC2=N1)C#N |
Product Overview
2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile (CAS 339029-89-9), with molecular formula C7H5N5S and molecular weight 191.03 g/mol. IUPAC: 2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile.
Chemical Property Profile of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Property Insights of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
The XLogP value of 0.71788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile. The TPSA of 66.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile. Following Lipinski's Rule of Five, 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile has 0 hydrogen bond donor(s) and 5 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-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile?
The CAS number of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile is 339029-89-9.
What is the molecular formula of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile?
The molecular formula of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile is C7H5N5S.
What is the molecular weight of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile?
The molecular weight of 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile is 191.03 g/mol.
Where can I buy 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile?
You can request a quote for 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.