![1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine structure](/static/products/4413/441314-89-2.webp)
1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine
TL;DR: 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine (CAS 441314-89-2) is a chemical compound with molecular formula C19H23FN2S and molecular weight 330.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine
Also Known As: 1-(4-fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine, 1-[(4-fluorophenyl)methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine, 4-{[4-(4-fluorobenzyl)-1-piperazinyl]methyl}phenyl methyl sulfide, 1-[(4-FLUOROPHENYL)METHYL]-4-{[4-(METHYLSULFANYL)PHENYL]METHYL}PIPERAZINE
| Molecular Formula | C19H23FN2S |
|---|---|
| Molecular Weight | 330.16 g/mol |
| LogP | 3.8654 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.1566 |
| Heavy Atoms | 23 |
| Complexity | 604.27167 |
Chemical Identifiers
| CAS Number | 441314-89-2 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=C(C=C3)F |
Product Overview
1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine (CAS 441314-89-2), with molecular formula C19H23FN2S and molecular weight 330.16 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine.
Chemical Property Profile of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine
Property Insights of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine
The XLogP value of 3.8654 indicates that 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine 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-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine?
The CAS number of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine is 441314-89-2.
What is the molecular formula of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine?
The molecular formula of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine is C19H23FN2S.
What is the molecular weight of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine?
The molecular weight of 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine is 330.16 g/mol.
Where can I buy 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine?
You can request a quote for 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]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-(methylsulfanyl)benzyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)-4-[4-(methylsulfanyl)benzyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.