![1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine structure](/static/products/7778/777868-83-4.webp)
1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine
TL;DR: 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine (CAS 777868-83-4) is a chemical compound with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-2-phenylsulfanylethanone
Also Known As: 1-(methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine, 1-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-2-phenylsulfanylethanone, 1-(4-mesylpiperazino)-2-phenyl-2-(phenylthio)ethanone, 1-(4-methylsulfonyl-1-piperazinyl)-2-phenyl-2-(phenylthio)ethanone, 1-[4-(methylsulfonyl)piperazinyl]-2-phenyl-2-phenylthioethan-1-one
| Molecular Formula | C19H22N2O3S2 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | 2.6238 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.10718 |
| Heavy Atoms | 26 |
| Complexity | 833.60266 |
Chemical Identifiers
| CAS Number | 777868-83-4 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3 |
Product Overview
1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine (CAS 777868-83-4), with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol. IUPAC: 1-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-2-phenylsulfanylethanone.
Chemical Property Profile of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine
Property Insights of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine
The XLogP value of 2.6238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine. With a topological polar surface area (TPSA) of 57.69 Ų, 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine 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-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine?
The CAS number of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine is 777868-83-4.
What is the molecular formula of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine?
The molecular formula of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine is C19H22N2O3S2.
What is the molecular weight of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine?
The molecular weight of 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine is 390.11 g/mol.
Where can I buy 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine?
You can request a quote for 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylsulfonyl)-4-[phenyl(phenylthio)acetyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.