![1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine structure](/static/products/893/893763-11-6.png)
1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine
TL;DR: 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine (CAS 893763-11-6) is a chemical compound with molecular formula C17H21N3O3 and molecular weight 315.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-5-[(4-ethylpiperazin-1-yl)methyl]-1,2-oxazole
Also Known As: 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine, A4065/0173209, 3-(1,3-benzodioxol-5-yl)-5-[(4-ethylpiperazin-1-yl)methyl]-1,2-oxazole, Piperazine, 1-[[3-(1,3-benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethyl-, 1-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2-OXAZOL-5-YL]METHYL}-4-ETHYLPIPERAZINE
| Molecular Formula | C17H21N3O3 |
|---|---|
| Molecular Weight | 315.16 g/mol |
| LogP | 2.2078 |
| Topological Polar Surface Area | 50.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.1583 |
| Heavy Atoms | 23 |
| Complexity | 677.47314 |
Chemical Identifiers
| CAS Number | 893763-11-6 |
|---|---|
| SMILES | CCN1CCN(CC1)CC2=CC(=NO2)C3=CC4=C(C=C3)OCO4 |
Product Overview
1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine (CAS 893763-11-6), with molecular formula C17H21N3O3 and molecular weight 315.16 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-5-[(4-ethylpiperazin-1-yl)methyl]-1,2-oxazole.
Chemical Property Profile of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine
Property Insights of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine
The XLogP value of 2.2078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine. With a topological polar surface area (TPSA) of 50.97 Ų, 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine has 0 hydrogen bond donor(s) and 6 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-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine?
The CAS number of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine is 893763-11-6.
What is the molecular formula of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine?
The molecular formula of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine is C17H21N3O3.
What is the molecular weight of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine?
The molecular weight of 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine is 315.16 g/mol.
Where can I buy 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine?
You can request a quote for 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[[3-(1,3-Benzodioxol-5-yl)-5-isoxazolyl]methyl]-4-ethylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.