![2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile structure](/static/products/7186/718600-45-4.webp)
2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile
TL;DR: 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile (CAS 718600-45-4) is a chemical compound with molecular formula C19H21ClN4 and molecular weight 340.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile
Also Known As: UPCMLD0ENAT5750358:001, 2-[4-(4-chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile, 2-(4-(4-chlorobenzyl)piperazin-1-yl)-4,6-dimethylnicotinonitrile, 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile, 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile
| Molecular Formula | C19H21ClN4 |
|---|---|
| Molecular Weight | 340.15 g/mol |
| LogP | 3.54572 |
| Topological Polar Surface Area | 43.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.14548 |
| Heavy Atoms | 24 |
| Complexity | 756.17163 |
Chemical Identifiers
| CAS Number | 718600-45-4 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C |
Product Overview
2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile (CAS 718600-45-4), with molecular formula C19H21ClN4 and molecular weight 340.15 g/mol. IUPAC: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile.
Chemical Property Profile of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile
Property Insights of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile
The XLogP value of 3.54572 indicates that 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.16 Ų, 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 4 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 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile?
The CAS number of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile is 718600-45-4.
What is the molecular formula of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile?
The molecular formula of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile is C19H21ClN4.
What is the molecular weight of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile?
The molecular weight of 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile is 340.15 g/mol.
Where can I buy 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile?
You can request a quote for 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-Chlorobenzyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.