![N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide structure](/static/products/956/956791-06-3.png)
N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide
TL;DR: N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide (CAS 956791-06-3) is a chemical compound with molecular formula C28H34N4O5S and molecular weight 538.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide
Also Known As: N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide, 4-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-3-nitro-N-(tricyclo[3.3.1.1~3,7~]dec-2-yl)benzamide, N-((1r,3r,5r,7r)-adamantan-2-yl)-3-nitro-4-(4-tosylpiperazin-1-yl)benzamide, N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzamide
| Molecular Formula | C28H34N4O5S |
|---|---|
| Molecular Weight | 538.23 g/mol |
| LogP | 3.96862 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.225 |
| Heavy Atoms | 38 |
| Complexity | 1323.799 |
Chemical Identifiers
| CAS Number | 956791-06-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4C5CC6CC(C5)CC4C6)[N+](=O)[O-] |
Product Overview
N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide (CAS 956791-06-3), with molecular formula C28H34N4O5S and molecular weight 538.23 g/mol. IUPAC: N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide.
Chemical Property Profile of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide
Property Insights of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide
The XLogP value of 3.96862 indicates that N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.86 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide?
The CAS number of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide is 956791-06-3.
What is the molecular formula of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide?
The molecular formula of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide is C28H34N4O5S.
What is the molecular weight of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide?
The molecular weight of N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide is 538.23 g/mol.
Where can I buy N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide?
You can request a quote for N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-adamantyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.