5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine
TL;DR: 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine (CAS 672950-87-7) is a chemical compound with molecular formula C16H9F4N3O and molecular weight 335.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine
Also Known As: 5-(4-fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine, 4-fluorophenyl 3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl ether, 5-(4-fluoranylphenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine
| Molecular Formula | C16H9F4N3O |
|---|---|
| Molecular Weight | 335.07 g/mol |
| LogP | 4.4888 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.06818 |
| Heavy Atoms | 24 |
| Complexity | 836.1914 |
Chemical Identifiers
| CAS Number | 672950-87-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=C(N=N2)C(F)(F)F)OC3=CC=C(C=C3)F |
Product Overview
5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine (CAS 672950-87-7), with molecular formula C16H9F4N3O and molecular weight 335.07 g/mol. IUPAC: 5-(4-fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine.
Chemical Property Profile of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine
Property Insights of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine
The XLogP value of 4.4888 indicates that 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine has 0 hydrogen bond donor(s) and 4 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-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine?
The CAS number of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine is 672950-87-7.
What is the molecular formula of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine?
The molecular formula of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine is C16H9F4N3O.
What is the molecular weight of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine?
The molecular weight of 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine is 335.07 g/mol.
Where can I buy 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine?
You can request a quote for 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-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-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.