4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether
TL;DR: 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether (CAS 452362-64-0) is a chemical compound with molecular formula C17H26N2O2 and molecular weight 290.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-tert-butylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: BAS 04944892, 4-tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether, AO-365/12810878, 2-(4-tert-butylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone, 2-(4-tert-Butyl-phenoxy)-1-(4-methyl-piperazin-1-yl)-ethanone
| Molecular Formula | C17H26N2O2 |
|---|---|
| Molecular Weight | 290.20 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.19943 |
| Heavy Atoms | 21 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 452362-64-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C |
| InChIKey | WGKOHXOQFVJDNG-UHFFFAOYSA-N |
Product Overview
4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether (CAS 452362-64-0), with molecular formula C17H26N2O2 and molecular weight 290.20 g/mol. IUPAC: 2-(4-tert-butylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether
Property Insights of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether. With a topological polar surface area (TPSA) of 32.8 Ų, 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether has 0 hydrogen bond donor(s) and 3 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 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether?
The CAS number of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether is 452362-64-0.
What is the molecular formula of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether?
The molecular formula of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether is C17H26N2O2.
What is the molecular weight of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether?
The molecular weight of 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether is 290.20 g/mol.
Where can I buy 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether?
You can request a quote for 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butylphenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.