![4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol structure](/static/products/5739/573931-39-2.webp)
4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol
TL;DR: 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol (CAS 573931-39-2) is a chemical compound with molecular formula C17H17ClN2OS and molecular weight 332.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-chlorophenyl)piperazin-1-yl]-(4-hydroxyphenyl)methanethione
Also Known As: 4-{[4-(3-chlorophenyl)-1-piperazinyl]carbonothioyl}phenol, 4-[4-(3-chlorophenyl)piperazin-4-ium-1-carbothioyl]phenolate, (4-(3-chlorophenyl)piperazin-1-yl)(4-hydroxyphenyl)methanethione, 4-[[4-(3-chlorophenyl)piperazin-1-yl]-sulfanylmethylidene]cyclohexa-2,5-dien-1-one, 4-[[4-(3-chlorophenyl)-1-piperazinyl]-mercaptomethylidene]-1-cyclohexa-2,5-dienone
| Molecular Formula | C17H17ClN2OS |
|---|---|
| Molecular Weight | 332.07 g/mol |
| LogP | 3.5433 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.075 |
| Heavy Atoms | 22 |
| Complexity | 666.6141 |
Chemical Identifiers
| CAS Number | 573931-39-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=CC=C2)Cl)C(=S)C3=CC=C(C=C3)O |
Product Overview
4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol (CAS 573931-39-2), with molecular formula C17H17ClN2OS and molecular weight 332.07 g/mol. IUPAC: [4-(3-chlorophenyl)piperazin-1-yl]-(4-hydroxyphenyl)methanethione.
Chemical Property Profile of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol
Property Insights of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol
The XLogP value of 3.5433 indicates that 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.71 Ų, 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol has 1 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 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol?
The CAS number of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol is 573931-39-2.
What is the molecular formula of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol?
The molecular formula of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol is C17H17ClN2OS.
What is the molecular weight of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol?
The molecular weight of 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol is 332.07 g/mol.
Where can I buy 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol?
You can request a quote for 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonothioyl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.