1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone
TL;DR: 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone (CAS 333757-41-8) is a chemical compound with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfonylpiperazin-1-yl)-2-phenoxyethanone
Also Known As: BAS 03050098, 1-(4-methylsulfonylpiperazin-1-yl)-2-phenoxyethanone, 1-[4-(methylsulfonyl)piperazin-1-yl]-2-phenoxyethanone, 1-(4-Methanesulfonyl-piperazin-1-yl)-2-phenoxy-ethanone, 1-[4-(methylsulfonyl)piperazinyl]-2-phenoxyethan-1-one
| Molecular Formula | C13H18N2O4S |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 0.1692 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.09872 |
| Heavy Atoms | 20 |
| Complexity | 550.9937 |
Chemical Identifiers
| CAS Number | 333757-41-8 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C(=O)COC2=CC=CC=C2 |
Product Overview
1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone (CAS 333757-41-8), with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol. IUPAC: 1-(4-methylsulfonylpiperazin-1-yl)-2-phenoxyethanone.
Chemical Property Profile of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone
Property Insights of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone
The XLogP value of 0.1692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone. Following Lipinski's Rule of Five, 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone has 0 hydrogen bond donor(s) and 4 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-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone?
The CAS number of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone is 333757-41-8.
What is the molecular formula of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone?
The molecular formula of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone is C13H18N2O4S.
What is the molecular weight of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone?
The molecular weight of 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone is 298.10 g/mol.
Where can I buy 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone?
You can request a quote for 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylsulfonylpiperazin-1-yl)-2-phenoxyethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.