![2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline structure](/static/products/5932/593237-70-8.webp)
2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline
TL;DR: 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline (CAS 593237-70-8) is a chemical compound with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline
Also Known As: 2-methyl-4-nitro-5-(4-tosylpiperazin-1-yl)aniline, 2-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline, 2-methyl-5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-4-nitroaniline
| Molecular Formula | C18H22N4O4S |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 2.30474 |
| Topological Polar Surface Area | 109.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.13617 |
| Heavy Atoms | 27 |
| Complexity | 965.6013 |
Chemical Identifiers
| CAS Number | 593237-70-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C(=C3)N)C)[N+](=O)[O-] |
Product Overview
2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline (CAS 593237-70-8), with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol. IUPAC: 2-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline.
Chemical Property Profile of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline
Property Insights of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline
The XLogP value of 2.30474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline. The TPSA of 109.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline. Following Lipinski's Rule of Five, 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline has 1 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 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline?
The CAS number of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline is 593237-70-8.
What is the molecular formula of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline?
The molecular formula of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline is C18H22N4O4S.
What is the molecular weight of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline?
The molecular weight of 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline is 390.14 g/mol.
Where can I buy 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline?
You can request a quote for 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.