1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine
TL;DR: 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine (CAS 697281-83-7) is a chemical compound with molecular formula C17H17F2N3O4S and molecular weight 397.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,6-difluorophenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine
Also Known As: 1-[(2,6-difluorophenyl)methyl]-4-(3-nitrobenzenesulfonyl)piperazine, 1-(2,6-difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine, F0921-7934, 1-[(2,6-difluorophenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine, 1-[(2,6-difluorophenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine
| Molecular Formula | C17H17F2N3O4S |
|---|---|
| Molecular Weight | 397.09 g/mol |
| LogP | 2.3795 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.0908 |
| Heavy Atoms | 27 |
| Complexity | 940.15094 |
Chemical Identifiers
| CAS Number | 697281-83-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=C(C=CC=C2F)F)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-] |
Product Overview
1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine (CAS 697281-83-7), with molecular formula C17H17F2N3O4S and molecular weight 397.09 g/mol. IUPAC: 1-[(2,6-difluorophenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine
Property Insights of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine
The XLogP value of 2.3795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(2,6-Difluorobenzyl)-4-((3-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-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine?
The CAS number of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine is 697281-83-7.
What is the molecular formula of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine?
The molecular formula of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine is C17H17F2N3O4S.
What is the molecular weight of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine?
The molecular weight of 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine is 397.09 g/mol.
Where can I buy 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine?
You can request a quote for 1-(2,6-Difluorobenzyl)-4-((3-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-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Difluorobenzyl)-4-((3-nitrophenyl)sulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.