![1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine structure](/static/products/4288/428836-33-3.webp)
1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine
TL;DR: 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine (CAS 428836-33-3) is a chemical compound with molecular formula C18H21N3O5S and molecular weight 391.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)sulfonyl-4-[(2-nitrophenyl)methyl]piperazine
Also Known As: BAS 01376104, 1-[(4-methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine, AT-057/40722646, 1-(4-methoxyphenyl)sulfonyl-4-[(2-nitrophenyl)methyl]piperazine, 1-{2-nitrobenzyl}-4-[(4-methoxyphenyl)sulfonyl]piperazine
| Molecular Formula | C18H21N3O5S |
|---|---|
| Molecular Weight | 391.12 g/mol |
| LogP | 2.1099 |
| Topological Polar Surface Area | 92.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.12018 |
| Heavy Atoms | 27 |
| Complexity | 906.84924 |
Chemical Identifiers
| CAS Number | 428836-33-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-] |
Product Overview
1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine (CAS 428836-33-3), with molecular formula C18H21N3O5S and molecular weight 391.12 g/mol. IUPAC: 1-(4-methoxyphenyl)sulfonyl-4-[(2-nitrophenyl)methyl]piperazine.
Chemical Property Profile of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine
Property Insights of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine
The XLogP value of 2.1099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine. The TPSA of 92.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine. Following Lipinski's Rule of Five, 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine has 0 hydrogen bond donor(s) and 6 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-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine?
The CAS number of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine is 428836-33-3.
What is the molecular formula of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine?
The molecular formula of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine is C18H21N3O5S.
What is the molecular weight of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine?
The molecular weight of 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine is 391.12 g/mol.
Where can I buy 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine?
You can request a quote for 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Methoxyphenyl)sulfonyl]-4-(2-nitrobenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.