2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
TL;DR: 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone (CAS 446250-61-9) is a chemical compound with molecular formula C13H16BrClN2O2 and molecular weight 346.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: 2-(4-Bromo-2-chlorophenoxy)-1-(4-methyl-1-piperazinyl)ethanone, 2-(4-bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone, 2-(4-bromo-2-chloro-phenoxy)-1-(4-methylpiperazin-1-yl)ethanone, 2-(4-bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethan-1-one
| Molecular Formula | C13H16BrClN2O2 |
|---|---|
| Molecular Weight | 346.01 g/mol |
| LogP | 2.2553 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.00836 |
| Heavy Atoms | 19 |
| Complexity | 461.95648 |
Chemical Identifiers
| CAS Number | 446250-61-9 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)COC2=C(C=C(C=C2)Br)Cl |
Product Overview
2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone (CAS 446250-61-9), with molecular formula C13H16BrClN2O2 and molecular weight 346.01 g/mol. IUPAC: 2-(4-bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
Property Insights of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
The XLogP value of 2.2553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone. With a topological polar surface area (TPSA) of 32.78 Ų, 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone 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 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The CAS number of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone is 446250-61-9.
What is the molecular formula of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular formula of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone is C13H16BrClN2O2.
What is the molecular weight of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular weight of 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone is 346.01 g/mol.
Where can I buy 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
You can request a quote for 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-2-chlorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.