2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
TL;DR: 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone (CAS 878429-75-5) is a chemical compound with molecular formula C19H19FN2O4 and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Also Known As: BAS 12772442, 2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone, 2-(2H-1,3-BENZODIOXOL-5-YLOXY)-1-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]ETHAN-1-ONE, 2-(2H-benzo[3,4-d]1,3-dioxolan-5-yloxy)-1-[4-(4-fluorophenyl)piperazinyl]ethan -1-one, 2-(Benzo[1,3]dioxol-5-yloxy)-1-[4-(4-fluoro-phenyl)-piperazin-1-yl]-ethanone
| Molecular Formula | C19H19FN2O4 |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 2.282 |
| Topological Polar Surface Area | 51.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.13287 |
| Heavy Atoms | 26 |
| Complexity | 788.62616 |
Chemical Identifiers
| CAS Number | 878429-75-5 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)C(=O)COC3=CC4=C(C=C3)OCO4 |
Product Overview
2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone (CAS 878429-75-5), with molecular formula C19H19FN2O4 and molecular weight 358.13 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone.
Chemical Property Profile of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Property Insights of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
The XLogP value of 2.282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone. With a topological polar surface area (TPSA) of 51.24 Ų, 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone 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 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone?
The CAS number of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone is 878429-75-5.
What is the molecular formula of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone?
The molecular formula of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone is C19H19FN2O4.
What is the molecular weight of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone?
The molecular weight of 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone is 358.13 g/mol.
Where can I buy 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone?
You can request a quote for 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzodioxol-5-yloxy)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.