![1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine structure](/static/products/878/878985-13-8.png)
1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine
TL;DR: 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine (CAS 878985-13-8) is a chemical compound with molecular formula C17H18ClN3O4S and molecular weight 395.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methylsulfonyl]-4-(4-nitrophenyl)piperazine
Also Known As: 1-[(2-chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine, 1-[(2-chlorophenyl)methylsulfonyl]-4-(4-nitrophenyl)piperazine, 1-{[(2-chlorophenyl)methyl]sulfonyl}-4-(4-nitrophenyl)piperazine
| Molecular Formula | C17H18ClN3O4S |
|---|---|
| Molecular Weight | 395.07 g/mol |
| LogP | 2.9002 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.07065 |
| Heavy Atoms | 26 |
| Complexity | 894.47894 |
Chemical Identifiers
| CAS Number | 878985-13-8 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC=CC=C3Cl |
Product Overview
1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine (CAS 878985-13-8), with molecular formula C17H18ClN3O4S and molecular weight 395.07 g/mol. IUPAC: 1-[(2-chlorophenyl)methylsulfonyl]-4-(4-nitrophenyl)piperazine.
Chemical Property Profile of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine
Property Insights of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine
The XLogP value of 2.9002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine. Following Lipinski's Rule of Five, 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)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-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine?
The CAS number of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine is 878985-13-8.
What is the molecular formula of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine?
The molecular formula of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine is C17H18ClN3O4S.
What is the molecular weight of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine?
The molecular weight of 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine is 395.07 g/mol.
Where can I buy 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine?
You can request a quote for 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)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-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Chlorobenzyl)sulfonyl]-4-(4-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.