1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine
TL;DR: 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine (CAS 425398-34-1) is a chemical compound with molecular formula C12H17FN2O2S and molecular weight 272.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-methylsulfonylpiperazine
Also Known As: 1-(4-fluorobenzyl)-4-(methylsulfonyl)piperazine, BAS 03050354, 1-[(4-fluorophenyl)methyl]-4-methylsulfonylpiperazine, AB00041034-01, 1-(4-Fluoro-benzyl)-4-methanesulfonyl-piperazine
| Molecular Formula | C12H17FN2O2S |
|---|---|
| Molecular Weight | 272.10 g/mol |
| LogP | 0.9029 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0995 |
| Heavy Atoms | 18 |
| Complexity | 493.31363 |
Chemical Identifiers
| CAS Number | 425398-34-1 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine (CAS 425398-34-1), with molecular formula C12H17FN2O2S and molecular weight 272.10 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-methylsulfonylpiperazine.
Chemical Property Profile of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine
Property Insights of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine
The XLogP value of 0.9029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine. With a topological polar surface area (TPSA) of 40.62 Ų, 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)-4-(methylsulfonyl)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-(methylsulfonyl)piperazine?
The CAS number of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine is 425398-34-1.
What is the molecular formula of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine?
The molecular formula of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine is C12H17FN2O2S.
What is the molecular weight of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine?
The molecular weight of 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine is 272.10 g/mol.
Where can I buy 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine?
You can request a quote for 1-(4-Fluorobenzyl)-4-(methylsulfonyl)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-(methylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)-4-(methylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.