![2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone structure](/static/products/6944/694484-39-4.webp)
2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
TL;DR: 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone (CAS 694484-39-4) is a chemical compound with molecular formula C19H20Cl2N2OS and molecular weight 394.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,6-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
Also Known As: AO-081/42095437, 2-[(2,6-dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone, 2-[(2,6-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone, 2,6-dichlorobenzyl 2-oxo-2-(4-phenyl-1-piperazinyl)ethyl sulfide
| Molecular Formula | C19H20Cl2N2OS |
|---|---|
| Molecular Weight | 394.07 g/mol |
| LogP | 4.5754 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.06735 |
| Heavy Atoms | 25 |
| Complexity | 698.36896 |
Chemical Identifiers
| CAS Number | 694484-39-4 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)CSCC3=C(C=CC=C3Cl)Cl |
Product Overview
2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone (CAS 694484-39-4), with molecular formula C19H20Cl2N2OS and molecular weight 394.07 g/mol. IUPAC: 2-[(2,6-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
Property Insights of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
The XLogP value of 4.5754 indicates that 2-[(2,6-Dichlorobenzyl)sulfanyl]-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-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2,6-Dichlorobenzyl)sulfanyl]-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-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone?
The CAS number of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone is 694484-39-4.
What is the molecular formula of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone?
The molecular formula of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone is C19H20Cl2N2OS.
What is the molecular weight of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone?
The molecular weight of 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone is 394.07 g/mol.
Where can I buy 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone?
You can request a quote for 2-[(2,6-Dichlorobenzyl)sulfanyl]-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-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,6-Dichlorobenzyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.