![1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one structure](/static/products/7669/76691-08-2.webp)
1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one
TL;DR: 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one (CAS 76691-08-2) is a chemical compound with molecular formula C20H20F2N2O and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one
Also Known As: (Z)-1-(3-fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]b, 1-(3-fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one
| Molecular Formula | C20H20F2N2O |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.15436 |
| Heavy Atoms | 25 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 76691-08-2 |
|---|---|
| SMILES | CC(=CC(=O)C1=CC(=CC=C1)F)N2CCN(CC2)C3=CC=C(C=C3)F |
| InChIKey | NXJRWRJFMYUQSD-UHFFFAOYSA-N |
Product Overview
1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one (CAS 76691-08-2), with molecular formula C20H20F2N2O and molecular weight 342.15 g/mol. IUPAC: 1-(3-fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one.
Chemical Property Profile of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one
Property Insights of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one
The XLogP value of 4.1 indicates that 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one 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 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one?
The CAS number of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one is 76691-08-2.
What is the molecular formula of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one?
The molecular formula of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one is C20H20F2N2O.
What is the molecular weight of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one?
The molecular weight of 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one is 342.15 g/mol.
Where can I buy 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one?
You can request a quote for 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.