3N-504S
TL;DR: 3N-504S (CAS 861212-34-2) is a chemical compound with molecular formula C24H22Cl2N4 and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
Also Known As: 3N-504S, 2-(4-chlorophenyl)-3-{[4-(3-chlorophenyl)piperazino]methyl}imidazo[1,2-a]pyridine, 1-(3-chlorophenyl)-4-{[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazine, 2-(4-chlorophenyl)-3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
| Molecular Formula | C24H22Cl2N4 |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 5.6303 |
| Topological Polar Surface Area | 23.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.12216 |
| Heavy Atoms | 30 |
| Complexity | 1161.5233 |
Chemical Identifiers
| CAS Number | 861212-34-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=C(N=C3N2C=CC=C3)C4=CC=C(C=C4)Cl)C5=CC(=CC=C5)Cl |
Product Overview
3N-504S (CAS 861212-34-2), with molecular formula C24H22Cl2N4 and molecular weight 436.12 g/mol. IUPAC: 2-(4-chlorophenyl)-3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine.
Chemical Property Profile of 3N-504S
Property Insights of 3N-504S
The XLogP value of 5.6303 indicates that 3N-504S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.78 Ų, 3N-504S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3N-504S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3N-504S?
The CAS number of 3N-504S is 861212-34-2.
What is the molecular formula of 3N-504S?
The molecular formula of 3N-504S is C24H22Cl2N4.
What is the molecular weight of 3N-504S?
The molecular weight of 3N-504S is 436.12 g/mol.
Where can I buy 3N-504S?
You can request a quote for 3N-504S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3N-504S?
Yes, KEHONG BIO provides custom synthesis services for 3N-504S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.