![2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide structure](/static/products/355/355430-47-6.png)
2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide
TL;DR: 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide (CAS 355430-47-6) is a chemical compound with molecular formula C11H9F3N4OS and molecular weight 302.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: BAS 04203953, BIM-0013945.P001, A2659/0113385, 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide, 2-(4H-1,2,4-triazol-3-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C11H9F3N4OS |
|---|---|
| Molecular Weight | 302.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.04492 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 355430-47-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CSC2=NC=NN2)C(F)(F)F |
| InChIKey | BUWMTEFUYKNUOX-UHFFFAOYSA-N |
Product Overview
2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide (CAS 355430-47-6), with molecular formula C11H9F3N4OS and molecular weight 302.04 g/mol. IUPAC: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide
Property Insights of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide. Following Lipinski's Rule of Five, 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide has 2 hydrogen bond donor(s) and 7 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-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide?
The CAS number of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide is 355430-47-6.
What is the molecular formula of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide?
The molecular formula of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide is C11H9F3N4OS.
What is the molecular weight of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide?
The molecular weight of 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide is 302.04 g/mol.
Where can I buy 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide?
You can request a quote for 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4H-[1,2,4]Triazol-3-ylsulfanyl)-N-(3-trifluoromethyl-phenyl)-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.