![2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone structure](/static/products/847/847366-32-9.png)
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone
TL;DR: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone (CAS 847366-32-9) is a chemical compound with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone
Also Known As: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone, 2-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone, 2-[4-(benzo[1,3]dioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone
| Molecular Formula | C22H22FN3O3 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 3.0362 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.16452 |
| Heavy Atoms | 29 |
| Complexity | 1056.6372 |
Chemical Identifiers
| CAS Number | 847366-32-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)C4=CNC5=C4C=C(C=C5)F |
Product Overview
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone (CAS 847366-32-9), with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol. IUPAC: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone.
Chemical Property Profile of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone
Property Insights of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone
The XLogP value of 3.0362 indicates that 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone 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 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone?
The CAS number of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone is 847366-32-9.
What is the molecular formula of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone?
The molecular formula of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone is C22H22FN3O3.
What is the molecular weight of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone?
The molecular weight of 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone is 395.16 g/mol.
Where can I buy 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone?
You can request a quote for 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-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-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.