![1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine structure](/static/products/866/866040-46-2.png)
1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine
TL;DR: 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine (CAS 866040-46-2) is a chemical compound with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-4-methylpiperazine
Also Known As: 1-[4-(1,3-benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine, 1-[4-(2H-1,3-benzodioxol-5-yloxy)but-2-yn-1-yl]-4-methylpiperazine, 1-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-4-methylpiperazine, 5W-0823, 1-(4-benzo[1,3]dioxol-5-yloxybut-2-ynyl)-4-methyl-piperazine
| Molecular Formula | C16H20N2O3 |
|---|---|
| Molecular Weight | 288.15 g/mol |
| LogP | 1.0449 |
| Topological Polar Surface Area | 34.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.1474 |
| Heavy Atoms | 21 |
| Complexity | 542.1885 |
Chemical Identifiers
| CAS Number | 866040-46-2 |
|---|---|
| SMILES | CN1CCN(CC1)CC#CCOC2=CC3=C(C=C2)OCO3 |
Product Overview
1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine (CAS 866040-46-2), with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol. IUPAC: 1-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-4-methylpiperazine.
Chemical Property Profile of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine
Property Insights of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine
The XLogP value of 1.0449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine. With a topological polar surface area (TPSA) of 34.17 Ų, 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine 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-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine?
The CAS number of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine is 866040-46-2.
What is the molecular formula of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine?
The molecular formula of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine is C16H20N2O3.
What is the molecular weight of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine?
The molecular weight of 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine is 288.15 g/mol.
Where can I buy 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine?
You can request a quote for 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(1,3-Benzodioxol-5-yloxy)-2-butynyl]-4-methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.