1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine
TL;DR: 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine (CAS 5000-03-3) is a chemical compound with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1,3-benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine
Also Known As: 1-[1,3-benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine, 1-[benzo[1,3]dioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine, 1-[(2H-1,3-Benzodioxol-5-yl)(2-ethoxyphenyl)methyl]piperazine
| Molecular Formula | C20H24N2O3 |
|---|---|
| Molecular Weight | 340.18 g/mol |
| LogP | 2.8086 |
| Topological Polar Surface Area | 42.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.17868 |
| Heavy Atoms | 25 |
| Complexity | 728.6312 |
Chemical Identifiers
| CAS Number | 5000-03-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(C2=CC3=C(C=C2)OCO3)N4CCNCC4 |
Product Overview
1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine (CAS 5000-03-3), with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol. IUPAC: 1-[1,3-benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine
Property Insights of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine
The XLogP value of 2.8086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine. With a topological polar surface area (TPSA) of 42.96 Ų, 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine 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 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine?
The CAS number of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine is 5000-03-3.
What is the molecular formula of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine?
The molecular formula of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine is C20H24N2O3.
What is the molecular weight of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine?
The molecular weight of 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine is 340.18 g/mol.
Where can I buy 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine?
You can request a quote for 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine 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-(2-ethoxyphenyl)methyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[1,3-Benzodioxol-5-yl-(2-ethoxyphenyl)methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.