4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine
TL;DR: 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine (CAS 430452-76-9) is a chemical compound with molecular formula C18H20ClN3O4S and molecular weight 409.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine
Also Known As: A3029/0127751, 4-(2-chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine, 4-(2-chloro-4-nitrophenyl)-2-methyl-1-[(4-methylphenyl)sulfonyl]piperazine, 4-(2-CHLORO-4-NITROPHENYL)-2-METHYL-1-(4-METHYLBENZENESULFONYL)PIPERAZINE
| Molecular Formula | C18H20ClN3O4S |
|---|---|
| Molecular Weight | 409.09 g/mol |
| LogP | 3.45602 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.0863 |
| Heavy Atoms | 27 |
| Complexity | 963.0721 |
Chemical Identifiers
| CAS Number | 430452-76-9 |
|---|---|
| SMILES | CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C)C3=C(C=C(C=C3)[N+](=O)[O-])Cl |
Product Overview
4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine (CAS 430452-76-9), with molecular formula C18H20ClN3O4S and molecular weight 409.09 g/mol. IUPAC: 4-(2-chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine.
Chemical Property Profile of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine
Property Insights of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine
The XLogP value of 3.45602 indicates that 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine. Following Lipinski's Rule of Five, 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine 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 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine?
The CAS number of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine is 430452-76-9.
What is the molecular formula of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine?
The molecular formula of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine is C18H20ClN3O4S.
What is the molecular weight of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine?
The molecular weight of 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine is 409.09 g/mol.
Where can I buy 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine?
You can request a quote for 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chloro-4-nitrophenyl)-2-methyl-1-(4-methylphenyl)sulfonylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.