![1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine structure](/static/products/4237/423753-95-1.webp)
1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine
TL;DR: 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine (CAS 423753-95-1) is a chemical compound with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methylphenoxy)-1-(4-methylsulfonylpiperazin-1-yl)ethanone
Also Known As: 1-[(3-methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine, 2-(3-methylphenoxy)-1-(4-methylsulfonylpiperazin-1-yl)ethanone, AT-057/43318398, 2-(3-methylphenoxy)-1-[4-(methylsulfonyl)piperazin-1-yl]ethanone, 2-(3-METHYLPHENOXY)-1-[4-(METHYLSULFONYL)PIPERAZINO]-1-ETHANONE
| Molecular Formula | C14H20N2O4S |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.11438 |
| Heavy Atoms | 21 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 423753-95-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C |
| InChIKey | ZNFYHUMSCRXHLC-UHFFFAOYSA-N |
Product Overview
1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine (CAS 423753-95-1), with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol. IUPAC: 2-(3-methylphenoxy)-1-(4-methylsulfonylpiperazin-1-yl)ethanone.
Chemical Property Profile of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine
Property Insights of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine. Following Lipinski's Rule of Five, 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine has 0 hydrogen bond donor(s) and 5 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-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine?
The CAS number of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine is 423753-95-1.
What is the molecular formula of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine?
The molecular formula of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine is C14H20N2O4S.
What is the molecular weight of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine?
The molecular weight of 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine is 312.11 g/mol.
Where can I buy 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine?
You can request a quote for 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3-Methylphenoxy)acetyl]-4-(methylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.