Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-
TL;DR: Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- (CAS 2194-75-4) is a chemical compound with molecular formula C20H21FN2O3 and molecular weight 356.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzodioxol-2-ylmethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanone
Also Known As: 1-(4-Fluorophenacyl)-4-piperonylpiperazine, 4'-Fluoro-2-(4-piperonyl-piperazin-1-yl)acetophenone, 5-23-02-00529 (Beilstein Handbook Reference), ACETOPHENONE, 4'-FLUORO-2-(4-PIPERONYLPIPERAZIN-1-YL)-, 2-(4-Benzo[1,3]dioxol-5-ylmethyl-piperazin-1-yl)-1-(4-fluoro-phenyl)-ethanone
| Molecular Formula | C20H21FN2O3 |
|---|---|
| Molecular Weight | 356.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.15363 |
| Heavy Atoms | 26 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 2194-75-4 |
|---|---|
| SMILES | C1CN(CCN1CC2OC3=CC=CC=C3O2)CC(=O)C4=CC=C(C=C4)F |
| InChIKey | GDDDHZNLRSVFKC-UHFFFAOYSA-N |
Product Overview
Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- (CAS 2194-75-4), with molecular formula C20H21FN2O3 and molecular weight 356.15 g/mol. IUPAC: 2-[4-(1,3-benzodioxol-2-ylmethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanone.
Chemical Property Profile of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-
Property Insights of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-
The XLogP value of 3.2 indicates that Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- has 0 hydrogen bond donor(s) and 6 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 Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-?
The CAS number of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- is 2194-75-4.
What is the molecular formula of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-?
The molecular formula of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- is C20H21FN2O3.
What is the molecular weight of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-?
The molecular weight of Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- is 356.15 g/mol.
Where can I buy Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-?
You can request a quote for Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetophenone, 4'-fluoro-2-(4-piperonylpiperazin-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.