![2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide structure](/static/products/895/895360-90-4.png)
2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
TL;DR: 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (CAS 895360-90-4) is a chemical compound with molecular formula C15H12N6OS and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 2-[(cyanomethyl)sulfanyl]-7-methyl-N-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, [2-(cyanomethylthio)-7-methyl(8-hydro-1,2,4-triazolo[1,5-a]pyrimidin-6-yl)]-N- benzamide, 2-((cyanomethyl)thio)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C15H12N6OS |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 2.3007 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.0793 |
| Heavy Atoms | 23 |
| Complexity | 899.46625 |
Chemical Identifiers
| CAS Number | 895360-90-4 |
|---|---|
| SMILES | CC1=C(C=NC2=NC(=NN12)SCC#N)C(=O)NC3=CC=CC=C3 |
Product Overview
2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (CAS 895360-90-4), with molecular formula C15H12N6OS and molecular weight 324.08 g/mol. IUPAC: 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
Chemical Property Profile of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Property Insights of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
The XLogP value of 2.3007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide. Following Lipinski's Rule of Five, 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide has 1 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 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The CAS number of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is 895360-90-4.
What is the molecular formula of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The molecular formula of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is C15H12N6OS.
What is the molecular weight of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The molecular weight of 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is 324.08 g/mol.
Where can I buy 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
You can request a quote for 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(cyanomethylsulfanyl)-7-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.