![5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine structure](/static/products/7134/71347-48-3.webp)
5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine
TL;DR: 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine (CAS 71347-48-3) is a chemical compound with molecular formula C10H8FN3S and molecular weight 221.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorophenyl)-3-methylsulfanyl-1,2,4-triazine
Also Known As: BAS 04381478, J2.840.616I, 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine, 5-(p-fluorophenyl)-3-(methylthio)-1,2,4-triazine, 3-(Methylthio)-5-(4-fluorophenyl)-1,2,4-triazine
| Molecular Formula | C10H8FN3S |
|---|---|
| Molecular Weight | 221.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.0423 |
| Heavy Atoms | 15 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 71347-48-3 |
|---|---|
| SMILES | CSC1=NC(=CN=N1)C2=CC=C(C=C2)F |
| InChIKey | PLFFPXGECLXPAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine (CAS 71347-48-3), with molecular formula C10H8FN3S and molecular weight 221.04 g/mol. IUPAC: 5-(4-fluorophenyl)-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine
Property Insights of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine. Following Lipinski's Rule of Five, 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine 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 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine?
The CAS number of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine is 71347-48-3.
What is the molecular formula of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine?
The molecular formula of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine is C10H8FN3S.
What is the molecular weight of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine?
The molecular weight of 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine is 221.04 g/mol.
Where can I buy 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine?
You can request a quote for 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Fluoro-phenyl)-3-methylsulfanyl-[1,2,4]triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.