1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone
TL;DR: 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone (CAS 344569-55-7) 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.
1-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazino]-1-propanone, 1-(Benzo[d][1,3]dioxol-5-yl)-3-(4-(4-fluorophenyl)piperazin-1-yl)propan-1-one, 1-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one, 1-(1,3-BENZODIOXOL-5-YL)-3-(4-(4-FLUOROPHENYL)-1-PIPERAZINYL)-1-PROPANONE, 1-(2H-1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
| Molecular Formula | C20H21FN2O3 |
|---|---|
| Molecular Weight | 356.15 g/mol |
| LogP | 2.9494 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.15363 |
| Heavy Atoms | 26 |
| Complexity | 786.1434 |
Chemical Identifiers
| CAS Number | 344569-55-7 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)F |
Product Overview
1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone (CAS 344569-55-7), with molecular formula C20H21FN2O3 and molecular weight 356.15 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone
Property Insights of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone
The XLogP value of 2.9494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone. With a topological polar surface area (TPSA) of 42.01 Ų, 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone 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-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone?
The CAS number of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone is 344569-55-7.
What is the molecular formula of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone?
The molecular formula of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone is C20H21FN2O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone?
The molecular weight of 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone is 356.15 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone?
You can request a quote for 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-YL)-3-(4-(4-fluorophenyl)-1-piperazinyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.