![4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline structure](/static/products/1164/1164451-26-6.webp)
4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline
TL;DR: 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline (CAS 1164451-26-6) is a chemical compound with molecular formula C13H13FN4S and molecular weight 276.0845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline
Also Known As: 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline, N-(4-fluorophenyl)-N-{2-[6-methyl-3-(methylsulfanyl)-1,2,4-triazin-5-yl]vinyl}amine
Technical Specifications
| Molecular Formula | C13H13FN4S |
| Molecular Weight | 276.0845 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.0845 Da |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
| SMILES | CC1=C(N=C(N=N1)SC)C=CNC2=CC=C(C=C2)F |
| InChIKey | QEYQECQAZMIWSQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline
Property Insights of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline. Following Lipinski's Rule of Five, 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline 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
What is the CAS number of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline?
The CAS number of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline is 1164451-26-6.
What is the molecular formula of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline?
The molecular formula of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline is C13H13FN4S.
What is the molecular weight of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline?
The molecular weight of 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline is 276.0845 g/mol.
Where can I buy 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline?
You can request a quote for 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline?
Yes, CoreyChem provides custom synthesis services for 4-fluoro-N-[2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.