![4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid structure](/static/products/287/287977-43-9.png)
4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid
TL;DR: 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid (CAS 287977-43-9) is a chemical compound with molecular formula C16H10FNO3 and molecular weight 283.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]benzoic acid
Also Known As: 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid, 4-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]benzoic Acid
| Molecular Formula | C16H10FNO3 |
|---|---|
| Molecular Weight | 283.06 g/mol |
| LogP | 3.8459 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.06448 |
| Heavy Atoms | 21 |
| Complexity | 776.04156 |
Chemical Identifiers
| CAS Number | 287977-43-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NOC(=C2)C3=CC=C(C=C3)F)C(=O)O |
Product Overview
4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid (CAS 287977-43-9), with molecular formula C16H10FNO3 and molecular weight 283.06 g/mol. IUPAC: 4-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]benzoic acid.
Chemical Property Profile of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid
Property Insights of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid
The XLogP value of 3.8459 indicates that 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid. Following Lipinski's Rule of Five, 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid has 1 hydrogen bond donor(s) and 3 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-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid?
The CAS number of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid is 287977-43-9.
What is the molecular formula of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid?
The molecular formula of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid is C16H10FNO3.
What is the molecular weight of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid?
The molecular weight of 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid is 283.06 g/mol.
Where can I buy 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid?
You can request a quote for 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-(4-Fluorophenyl)-3-isoxazolyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.