2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid
TL;DR: 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid (CAS 344280-55-3) is a chemical compound with molecular formula C17H15FO4 and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid
Also Known As: 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid, Bionet2_000984, 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoicacid, 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxo-butanoic acid, I+/--(4-Fluorophenyl)-3-methoxy-I(3)-oxobenzenebutanoic acid
| Molecular Formula | C17H15FO4 |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.2755 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.09543 |
| Heavy Atoms | 22 |
| Complexity | 679.31323 |
Chemical Identifiers
| CAS Number | 344280-55-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)CC(C2=CC=C(C=C2)F)C(=O)O |
Product Overview
2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid (CAS 344280-55-3), with molecular formula C17H15FO4 and molecular weight 302.10 g/mol. IUPAC: 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid.
Chemical Property Profile of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid
Property Insights of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid
The XLogP value of 3.2755 indicates that 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic 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 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid?
The CAS number of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid is 344280-55-3.
What is the molecular formula of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid?
The molecular formula of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid is C17H15FO4.
What is the molecular weight of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid?
The molecular weight of 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid is 302.10 g/mol.
Where can I buy 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid?
You can request a quote for 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.