![N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline structure](/static/products/5318/5318-22-9.webp)
N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline
TL;DR: N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline (CAS 5318-22-9) is a chemical compound with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-N-(2-methyl-5-nitrophenyl)methanimine
Also Known As: N-(4-bromobenzylidene)-2-methyl-5-nitroaniline, n-[(e)-(4-bromophenyl)methylene]-2-methyl-5-nitroaniline, 1-(4-bromophenyl)-N-(2-methyl-5-nitrophenyl)methanimine, A0752/0035150, N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline
| Molecular Formula | C14H11BrN2O2 |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.0004 |
| Heavy Atoms | 19 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 5318-22-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])N=CC2=CC=C(C=C2)Br |
| InChIKey | ZWSSPFXMSQKXID-UHFFFAOYSA-N |
Product Overview
N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline (CAS 5318-22-9), with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol. IUPAC: 1-(4-bromophenyl)-N-(2-methyl-5-nitrophenyl)methanimine.
Chemical Property Profile of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline
Property Insights of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline
The XLogP value of 4.1 indicates that N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline 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 N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline?
The CAS number of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline is 5318-22-9.
What is the molecular formula of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline?
The molecular formula of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline is C14H11BrN2O2.
What is the molecular weight of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline?
The molecular weight of N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline is 318.00 g/mol.
Where can I buy N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline?
You can request a quote for N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-(4-bromophenyl)methylidene]-2-methyl-5-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.