3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline
TL;DR: 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline (CAS 640759-21-3) is a chemical compound with molecular formula C17H19Cl2N3 and molecular weight 335.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]aniline
Also Known As: starbld0012542, 3-chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline, 3-chloro-4-[4-(2-chlorobenzyl)piperazin-1-yl]aniline, 3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]aniline, 3-CHLORO-4-{4-[(2-CHLOROPHENYL)METHYL]PIPERAZIN-1-YL}ANILINE
| Molecular Formula | C17H19Cl2N3 |
|---|---|
| Molecular Weight | 335.10 g/mol |
| LogP | 3.8978 |
| Topological Polar Surface Area | 32.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.0956 |
| Heavy Atoms | 22 |
| Complexity | 652.10236 |
Chemical Identifiers
| CAS Number | 640759-21-3 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)N)Cl |
Product Overview
3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline (CAS 640759-21-3), with molecular formula C17H19Cl2N3 and molecular weight 335.10 g/mol. IUPAC: 3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]aniline.
Chemical Property Profile of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline
Property Insights of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline
The XLogP value of 3.8978 indicates that 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.5 Ų, 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline has 1 hydrogen bond donor(s) and 3 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 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline?
The CAS number of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline is 640759-21-3.
What is the molecular formula of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline?
The molecular formula of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline is C17H19Cl2N3.
What is the molecular weight of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline?
The molecular weight of 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline is 335.10 g/mol.
Where can I buy 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline?
You can request a quote for 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-(4-(2-chlorobenzyl)piperazin-1-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.