![N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide structure](/static/products/6944/694451-13-3.webp)
N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide
TL;DR: N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide (CAS 694451-13-3) is a chemical compound with molecular formula C23H23ClN4O and molecular weight 406.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide
Also Known As: N-{4-[4-(2-chlorobenzyl)piperazin-1-yl]phenyl}pyridine-3-carboxamide, N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide, N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide
| Molecular Formula | C23H23ClN4O |
|---|---|
| Molecular Weight | 406.16 g/mol |
| LogP | 4.3095 |
| Topological Polar Surface Area | 48.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.15604 |
| Heavy Atoms | 29 |
| Complexity | 954.1266 |
Chemical Identifiers
| CAS Number | 694451-13-3 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2Cl)C3=CC=C(C=C3)NC(=O)C4=CN=CC=C4 |
Product Overview
N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide (CAS 694451-13-3), with molecular formula C23H23ClN4O and molecular weight 406.16 g/mol. IUPAC: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide.
Chemical Property Profile of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide
Property Insights of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide
The XLogP value of 4.3095 indicates that N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.47 Ų, N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide has 1 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 N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide?
The CAS number of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide is 694451-13-3.
What is the molecular formula of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide?
The molecular formula of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide is C23H23ClN4O.
What is the molecular weight of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide?
The molecular weight of N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide is 406.16 g/mol.
Where can I buy N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide?
You can request a quote for N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-{4-[4-(2-chlorobenzyl)-1-piperazinyl]phenyl}nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.