![N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline structure](/static/products/3308/330829-97-5.webp)
N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline
TL;DR: N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline (CAS 330829-97-5) is a chemical compound with molecular formula C18H21ClN4O3 and molecular weight 376.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline
Also Known As: BAS 02859701, N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-(piperazin-1-yl)aniline, N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline, [2-(4-Chloro-phenoxy)-ethyl]-(2-nitro-5-piperazin-1-yl-phenyl)-amine, [2-(4-chlorophenoxy)ethyl](2-nitro-5-piperazinylphenyl)amine
| Molecular Formula | C18H21ClN4O3 |
|---|---|
| Molecular Weight | 376.13 g/mol |
| LogP | 3.1487 |
| Topological Polar Surface Area | 79.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.13022 |
| Heavy Atoms | 26 |
| Complexity | 748.60144 |
Chemical Identifiers
| CAS Number | 330829-97-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCCOC3=CC=C(C=C3)Cl |
Product Overview
N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline (CAS 330829-97-5), with molecular formula C18H21ClN4O3 and molecular weight 376.13 g/mol. IUPAC: N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline.
Chemical Property Profile of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline
Property Insights of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline
The XLogP value of 3.1487 indicates that N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline. Following Lipinski's Rule of Five, N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline has 2 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-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline?
The CAS number of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline is 330829-97-5.
What is the molecular formula of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline?
The molecular formula of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline is C18H21ClN4O3.
What is the molecular weight of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline?
The molecular weight of N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline is 376.13 g/mol.
Where can I buy N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline?
You can request a quote for N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-chlorophenoxy)ethyl]-2-nitro-5-piperazin-1-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.