![1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine structure](/static/products/4253/425390-01-8.webp)
1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine
TL;DR: 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine (CAS 425390-01-8) is a chemical compound with molecular formula C18H21FN2O2S and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine
Also Known As: BAS 03050495, BIM-0003662.P001, 1-(4-fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine, 1-(4-Fluoro-benzyl)-4-(toluene-4-sulfonyl)-piperazine, 1-[(4-fluorophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine
| Molecular Formula | C18H21FN2O2S |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.13077 |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 425390-01-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)F |
| InChIKey | KEMZQRCDNLRUCY-UHFFFAOYSA-N |
Product Overview
1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine (CAS 425390-01-8), with molecular formula C18H21FN2O2S and molecular weight 348.13 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine
Property Insights of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine. With a topological polar surface area (TPSA) of 49.0 Ų, 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine has 0 hydrogen bond donor(s) and 5 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-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine?
The CAS number of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine is 425390-01-8.
What is the molecular formula of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine?
The molecular formula of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine is C18H21FN2O2S.
What is the molecular weight of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine?
The molecular weight of 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine is 348.13 g/mol.
Where can I buy 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine?
You can request a quote for 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.