1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone
TL;DR: 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone (CAS 84529-54-4) is a chemical compound with molecular formula C13H17BrN2O and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone
Also Known As: 1-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone, 1-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)ethan-1-one, A-3194, I13-360, A3027/0127667
| Molecular Formula | C13H17BrN2O |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 1.8792 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.05243 |
| Heavy Atoms | 17 |
| Complexity | 382.91086 |
Chemical Identifiers
| CAS Number | 84529-54-4 |
|---|---|
| SMILES | CN1CCN(CC1)CC(=O)C2=CC=C(C=C2)Br |
Product Overview
1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone (CAS 84529-54-4), with molecular formula C13H17BrN2O and molecular weight 296.05 g/mol. IUPAC: 1-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone
Property Insights of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone
The XLogP value of 1.8792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-2-(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 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone?
The CAS number of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone is 84529-54-4.
What is the molecular formula of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone?
The molecular formula of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone is C13H17BrN2O.
What is the molecular weight of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone?
The molecular weight of 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone is 296.05 g/mol.
Where can I buy 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone?
You can request a quote for 1-(4-Bromophenyl)-2-(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 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-2-(4-methylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.