![3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one structure](/static/products/4237/423744-99-4.webp)
3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one
TL;DR: 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one (CAS 423744-99-4) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one
Also Known As: 3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one, 3-methyl-1-{4-[(3-methylphenoxy)acetyl]piperazin-1-yl}butan-1-one, 3-METHYL-1-{4-[2-(3-METHYLPHENOXY)ACETYL]PIPERAZINO}-1-BUTANONE
| Molecular Formula | C18H26N2O3 |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 2.09072 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.19434 |
| Heavy Atoms | 23 |
| Complexity | 548.95264 |
Chemical Identifiers
| CAS Number | 423744-99-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C(=O)CC(C)C |
Product Overview
3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one (CAS 423744-99-4), with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol. IUPAC: 3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one.
Chemical Property Profile of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one
Property Insights of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one
The XLogP value of 2.09072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one. With a topological polar surface area (TPSA) of 49.85 Ų, 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one 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 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one?
The CAS number of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one is 423744-99-4.
What is the molecular formula of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one?
The molecular formula of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one is C18H26N2O3.
What is the molecular weight of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one?
The molecular weight of 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one is 318.19 g/mol.
Where can I buy 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one?
You can request a quote for 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.