![1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine structure](/static/products/4288/428849-53-0.webp)
1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine
TL;DR: 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine (CAS 428849-53-0) is a chemical compound with molecular formula C17H18FN3O4S and molecular weight 379.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-fluorophenyl)methyl]-4-(4-nitrophenyl)sulfonylpiperazine
Also Known As: BAS 03152312, 1-(2-fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine, 1-[(2-fluorophenyl)methyl]-4-(4-nitrophenyl)sulfonylpiperazine, 1-(2-Fluoro-benzyl)-4-(4-nitro-benzenesulfonyl)-piperazine, 1-[(2-FLUOROPHENYL)METHYL]-4-(4-NITROBENZENESULFONYL)PIPERAZINE
| Molecular Formula | C17H18FN3O4S |
|---|---|
| Molecular Weight | 379.10 g/mol |
| LogP | 2.2404 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.10022 |
| Heavy Atoms | 26 |
| Complexity | 894.47894 |
Chemical Identifiers
| CAS Number | 428849-53-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine (CAS 428849-53-0), with molecular formula C17H18FN3O4S and molecular weight 379.10 g/mol. IUPAC: 1-[(2-fluorophenyl)methyl]-4-(4-nitrophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine
Property Insights of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine
The XLogP value of 2.2404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine. Following Lipinski's Rule of Five, 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)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-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine?
The CAS number of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine is 428849-53-0.
What is the molecular formula of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine?
The molecular formula of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine is C17H18FN3O4S.
What is the molecular weight of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine?
The molecular weight of 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine is 379.10 g/mol.
Where can I buy 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine?
You can request a quote for 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)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-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Fluorobenzyl)-4-[(4-nitrophenyl)sulfonyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.