![4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid structure](/static/products/3545/354551-55-6.webp)
4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid
TL;DR: 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid (CAS 354551-55-6) is a chemical compound with molecular formula C14H17FN2O3 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid
Also Known As: 4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid, 4-(4-(4-Fluorophenyl)piperazin-1-yl)-4-oxobutanoic acid, 1-piperazinebutanoic acid, 4-(4-fluorophenyl)-gamma-oxo-, Butanoic acid, 4-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxo-, 4-4-(4-Fluorophenyl)piperazin-1-yl-4-oxobutanoic Acid
| Molecular Formula | C14H17FN2O3 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.1223 |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 354551-55-6 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC(=O)O |
| InChIKey | JCLJIIGKSJEXHQ-UHFFFAOYSA-N |
Product Overview
4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid (CAS 354551-55-6), with molecular formula C14H17FN2O3 and molecular weight 280.12 g/mol. IUPAC: 4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid.
Chemical Property Profile of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid
Property Insights of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid has 1 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-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid?
The CAS number of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid is 354551-55-6.
What is the molecular formula of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid?
The molecular formula of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid is C14H17FN2O3.
What is the molecular weight of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid?
The molecular weight of 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid is 280.12 g/mol.
Where can I buy 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid?
You can request a quote for 4-[4-(4-Fluorophenyl)piperazin-1-yl]-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 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-Fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.