2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
TL;DR: 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide (CAS 879467-20-6) is a chemical compound with molecular formula C13H13ClN8OS and molecular weight 364.06216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-chloro-2-pyridinyl)acetamide
Also Known As: 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide, 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-chloropyridin-2-yl)acetamide, 2-[4-amino-5-(3-methylpyrazol-5-yl)(1,2,4-triazol-3-ylthio)]-N-(5-chloro(2-pyr idyl))acetamide
Technical Specifications
| Molecular Formula | C13H13ClN8OS |
| Molecular Weight | 364.06216 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.06216 Da |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
| SMILES | CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)NC3=NC=C(C=C3)Cl |
| InChIKey | SAKMHXDKAQZLCY-UHFFFAOYSA-N |
Chemical Property Profile of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
Property Insights of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide. The TPSA of 153.0 Ų indicates high polarity, suggesting 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The CAS number of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is 879467-20-6.
What is the molecular formula of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The molecular formula of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is C13H13ClN8OS.
What is the molecular weight of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The molecular weight of 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is 364.06216 g/mol.
Where can I buy 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
You can request a quote for 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for 2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.