2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone
TL;DR: 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone (CAS 403833-51-2) 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-benzylsulfanyl-1-(4-phenylpiperazin-1-yl)ethanone
Also Known As: IFLab1_004515, IFLab2_000057, IDI1_010270, IDI1_019083, 1-[(benzylthio)acetyl]-4-phenylpiperazine
| Molecular Formula | C19H22N2OS |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 3.2686 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.1453 |
| Heavy Atoms | 23 |
| Complexity | 609.78143 |
Chemical Identifiers
| CAS Number | 403833-51-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)CSCC3=CC=CC=C3 |
Product Overview
2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone (CAS 403833-51-2), with molecular formula C19H22N2OS and molecular weight 326.15 g/mol. IUPAC: 2-benzylsulfanyl-1-(4-phenylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone
Property Insights of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone
The XLogP value of 3.2686 indicates that 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)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, 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)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 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone?
The CAS number of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone is 403833-51-2.
What is the molecular formula of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone?
The molecular formula of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone is C19H22N2OS.
What is the molecular weight of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone?
The molecular weight of 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone is 326.15 g/mol.
Where can I buy 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone?
You can request a quote for 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylthio)-1-(4-phenylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.