2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
TL;DR: 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone (CAS 429629-01-6) is a chemical compound with molecular formula C14H19ClN2O2 and molecular weight 282.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: BAS 08979450, 2-(4-Chloro-3-methylphenoxy)-1-(4-methyl-1-piperazinyl)ethanone, 2-(4-chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone, 2-(4-chloro-3-methylphenoxy)-1-(4-methylpiperazinyl)ethan-1-one, 2-(4-Chloro-3-methyl-phenoxy)-1-(4-methyl-piperazin-1-yl)-ethanone
| Molecular Formula | C14H19ClN2O2 |
|---|---|
| Molecular Weight | 282.11 g/mol |
| LogP | 1.80122 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.1135 |
| Heavy Atoms | 19 |
| Complexity | 456.75922 |
Chemical Identifiers
| CAS Number | 429629-01-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)C)Cl |
Product Overview
2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone (CAS 429629-01-6), with molecular formula C14H19ClN2O2 and molecular weight 282.11 g/mol. IUPAC: 2-(4-chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
Property Insights of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
The XLogP value of 1.80122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone. With a topological polar surface area (TPSA) of 32.78 Ų, 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chloro-3-methylphenoxy)-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-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The CAS number of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone is 429629-01-6.
What is the molecular formula of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular formula of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone is C14H19ClN2O2.
What is the molecular weight of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular weight of 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone is 282.11 g/mol.
Where can I buy 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
You can request a quote for 2-(4-Chloro-3-methylphenoxy)-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-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-3-methylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.