4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine
TL;DR: 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine (CAS 478080-85-2) is a chemical compound with molecular formula C17H13FN2O3S and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-fluorophenoxy)-5-methylsulfonyl-2-phenylpyrimidine
Also Known As: 4-(4-fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine, 4-(4-fluorophenoxy)-5-methanesulfonyl-2-phenylpyrimidine, 4-(4-fluorophenoxy)-5-methylsulfonyl-2-phenylpyrimidine
| Molecular Formula | C17H13FN2O3S |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | 3.4785 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.06308 |
| Heavy Atoms | 24 |
| Complexity | 958.8856 |
Chemical Identifiers
| CAS Number | 478080-85-2 |
|---|---|
| SMILES | CS(=O)(=O)C1=CN=C(N=C1OC2=CC=C(C=C2)F)C3=CC=CC=C3 |
Product Overview
4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine (CAS 478080-85-2), with molecular formula C17H13FN2O3S and molecular weight 344.06 g/mol. IUPAC: 4-(4-fluorophenoxy)-5-methylsulfonyl-2-phenylpyrimidine.
Chemical Property Profile of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine
Property Insights of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine
The XLogP value of 3.4785 indicates that 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine. Following Lipinski's Rule of Five, 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine 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 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine?
The CAS number of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine is 478080-85-2.
What is the molecular formula of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine?
The molecular formula of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine is C17H13FN2O3S.
What is the molecular weight of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine?
The molecular weight of 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine is 344.06 g/mol.
Where can I buy 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine?
You can request a quote for 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Fluorophenoxy)-5-(methylsulfonyl)-2-phenylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.