(E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine
TL;DR: (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine (CAS 303092-63-9) is a chemical compound with molecular formula C18H19BrFN3 and molecular weight 375.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4-benzylpiperazin-1-yl)-1-(5-bromo-2-fluorophenyl)methanimine
Also Known As: (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine, N-(4-benzylpiperazin-1-yl)-1-(5-bromo-2-fluoro-phenyl)methanimine, N-(4-benzylpiperazin-1-yl)-1-(5-bromo-2-fluorophenyl)methanimine, (E)-N-(4-benzylpiperazin-1-yl)-1-(5-bromo-2-fluorophenyl)methanimine, 4-benzyl-N-[(E)-(5-bromo-2-fluorophenyl)methylidene]piperazin-1-amine
| Molecular Formula | C18H19BrFN3 |
|---|---|
| Molecular Weight | 375.07 g/mol |
| LogP | 3.7399 |
| Topological Polar Surface Area | 18.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.07465 |
| Heavy Atoms | 23 |
| Complexity | 667.22186 |
Chemical Identifiers
| CAS Number | 303092-63-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)/N=C/C3=C(C=CC(=C3)Br)F |
Product Overview
(E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine (CAS 303092-63-9), with molecular formula C18H19BrFN3 and molecular weight 375.07 g/mol. IUPAC: (E)-N-(4-benzylpiperazin-1-yl)-1-(5-bromo-2-fluorophenyl)methanimine.
Chemical Property Profile of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine
Property Insights of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine
The XLogP value of 3.7399 indicates that (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.84 Ų, (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine has 0 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 (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine?
The CAS number of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine is 303092-63-9.
What is the molecular formula of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine?
The molecular formula of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine is C18H19BrFN3.
What is the molecular weight of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine?
The molecular weight of (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine is 375.07 g/mol.
Where can I buy (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine?
You can request a quote for (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-benzyl-N-(5-bromo-2-fluorobenzylidene)piperazin-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.