![N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine structure](/static/products/956/956791-49-4.png)
N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine
TL;DR: N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine (CAS 956791-49-4) is a chemical compound with molecular formula C26H32N4O4S and molecular weight 496.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine
Also Known As: N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine, N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-phenyl]adamantan-2-amine, N-{2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]phenyl}tricyclo[3.3.1.1~3,7~]decan-2-amine
| Molecular Formula | C26H32N4O4S |
|---|---|
| Molecular Weight | 496.21 g/mol |
| LogP | 4.3423 |
| Topological Polar Surface Area | 95.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.21442 |
| Heavy Atoms | 35 |
| Complexity | 1183.1125 |
Chemical Identifiers
| CAS Number | 956791-49-4 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NC3C4CC5CC(C4)CC3C5)S(=O)(=O)C6=CC=CC=C6 |
Product Overview
N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine (CAS 956791-49-4), with molecular formula C26H32N4O4S and molecular weight 496.21 g/mol. IUPAC: N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine.
Chemical Property Profile of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine
Property Insights of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine
The XLogP value of 4.3423 indicates that N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.79 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine. Following Lipinski's Rule of Five, N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine 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 N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine?
The CAS number of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine is 956791-49-4.
What is the molecular formula of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine?
The molecular formula of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine is C26H32N4O4S.
What is the molecular weight of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine?
The molecular weight of N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine is 496.21 g/mol.
Where can I buy N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine?
You can request a quote for N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl]adamantan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.