![1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine structure](/static/products/5342/5342-53-0.webp)
1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine
TL;DR: 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine (CAS 5342-53-0) is a chemical compound with molecular formula C11H14ClN3O4S and molecular weight 319.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-3-nitrophenyl)sulfonyl-4-methylpiperazine
Also Known As: 1-[(4-chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine, 1-(4-Chloro-3-nitrobenzenesulfonyl)-4-methylpiperazine, 1-(4-chloro-3-nitrophenyl)sulfonyl-4-methylpiperazine, BAS 00521381, 1-((4-Chloro-3-nitrophenyl)sulfonyl)-4-methylpiperazine
| Molecular Formula | C11H14ClN3O4S |
|---|---|
| Molecular Weight | 319.04 g/mol |
| LogP | 1.1843 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.03937 |
| Heavy Atoms | 20 |
| Complexity | 626.5554 |
Chemical Identifiers
| CAS Number | 5342-53-0 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine (CAS 5342-53-0), with molecular formula C11H14ClN3O4S and molecular weight 319.04 g/mol. IUPAC: 1-(4-chloro-3-nitrophenyl)sulfonyl-4-methylpiperazine.
Chemical Property Profile of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine
Property Insights of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine
The XLogP value of 1.1843 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine. Following Lipinski's Rule of Five, 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine 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-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine?
The CAS number of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine is 5342-53-0.
What is the molecular formula of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine?
The molecular formula of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine is C11H14ClN3O4S.
What is the molecular weight of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine?
The molecular weight of 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine is 319.04 g/mol.
Where can I buy 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine?
You can request a quote for 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chloro-3-nitrophenyl)sulfonyl]-4-methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.