![1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine structure](/static/products/3473/347353-85-9.webp)
1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine
TL;DR: 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine (CAS 347353-85-9) is a chemical compound with molecular formula C18H21ClN4O2 and molecular weight 360.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
Also Known As: BIM-0002847.P001, 1-{3-[(4-chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine, AN-465/14458058, A2271/0095700, N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
| Molecular Formula | C18H21ClN4O2 |
|---|---|
| Molecular Weight | 360.14 g/mol |
| LogP | 3.6121 |
| Topological Polar Surface Area | 61.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.1353 |
| Heavy Atoms | 25 |
| Complexity | 743.24133 |
Chemical Identifiers
| CAS Number | 347353-85-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)Cl |
Product Overview
1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine (CAS 347353-85-9), with molecular formula C18H21ClN4O2 and molecular weight 360.14 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline.
Chemical Property Profile of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine
Property Insights of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine
The XLogP value of 3.6121 indicates that 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine. Following Lipinski's Rule of Five, 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine has 1 hydrogen bond donor(s) and 5 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-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine?
The CAS number of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine is 347353-85-9.
What is the molecular formula of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine?
The molecular formula of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine is C18H21ClN4O2.
What is the molecular weight of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine?
The molecular weight of 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine is 360.14 g/mol.
Where can I buy 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine?
You can request a quote for 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-{3-[(4-Chlorobenzyl)amino]-4-nitrophenyl}-4-methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.