1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone
TL;DR: 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone (CAS 335212-65-2) is a chemical compound with molecular formula C19H22N2OS and molecular weight 326.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone
Also Known As: BAS 02813735, 1-(4-phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone, 1-(4-phenyl-1-piperazinyl)-2-(p-tolylthio)-1-ethanone, 1-(4-Phenyl-piperazin-1-yl)-2-p-tolylsulfanyl-ethanone, 2-[(4-methylphenyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethan-1-one
| Molecular Formula | C19H22N2OS |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 3.43592 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.1453 |
| Heavy Atoms | 23 |
| Complexity | 634.179 |
Chemical Identifiers
| CAS Number | 335212-65-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3 |
Product Overview
1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone (CAS 335212-65-2), with molecular formula C19H22N2OS and molecular weight 326.15 g/mol. IUPAC: 2-(4-methylphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone.
Chemical Property Profile of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone
Property Insights of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone
The XLogP value of 3.43592 indicates that 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)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 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone?
The CAS number of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone is 335212-65-2.
What is the molecular formula of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone?
The molecular formula of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone is C19H22N2OS.
What is the molecular weight of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone?
The molecular weight of 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone is 326.15 g/mol.
Where can I buy 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone?
You can request a quote for 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Phenylpiperazin-1-yl)-2-(p-tolylthio)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.