N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine
TL;DR: N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine (CAS 80401-89-4) is a chemical compound with molecular formula C17H18N4O2 and molecular weight 310.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-nitrophenyl)-N-(4-phenylpiperazin-1-yl)methanimine
Also Known As: (E)-N-(4-nitrobenzylidene)-4-phenylpiperazin-1-amine, N-(4-NITROBENZYLIDENE)-4-PHENYL-1-PIPERAZINAMINE, 1-(4-nitrophenyl)-N-(4-phenylpiperazin-1-yl)methanimine, N-[(E)-(4-nitrophenyl)methylidene]-4-phenylpiperazin-1-amine
| Molecular Formula | C17H18N4O2 |
|---|---|
| Molecular Weight | 310.14 g/mol |
| LogP | 2.7509 |
| Topological Polar Surface Area | 61.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.14297 |
| Heavy Atoms | 23 |
| Complexity | 677.4994 |
Chemical Identifiers
| CAS Number | 80401-89-4 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)/N=C/C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine (CAS 80401-89-4), with molecular formula C17H18N4O2 and molecular weight 310.14 g/mol. IUPAC: (E)-1-(4-nitrophenyl)-N-(4-phenylpiperazin-1-yl)methanimine.
Chemical Property Profile of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine
Property Insights of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine
The XLogP value of 2.7509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine. The TPSA of 61.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine. Following Lipinski's Rule of Five, N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine has 0 hydrogen bond donor(s) and 5 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-Nitrobenzylidene)-4-phenyl-1-piperazinamine?
The CAS number of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine is 80401-89-4.
What is the molecular formula of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine?
The molecular formula of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine is C17H18N4O2.
What is the molecular weight of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine?
The molecular weight of N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine is 310.14 g/mol.
Where can I buy N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine?
You can request a quote for N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Nitrobenzylidene)-4-phenyl-1-piperazinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.