N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline
TL;DR: N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline (CAS 303758-87-4) is a chemical compound with molecular formula C16H15FN2O4 and molecular weight 318.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethoxy-2-nitrophenyl)-N-(3-fluoro-4-methylphenyl)methanimine
Also Known As: N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline, AN-329/10741043, 1-(4,5-dimethoxy-2-nitrophenyl)-N-(3-fluoro-4-methylphenyl)methanimine, n-[(e)-(4,5-dimethoxy-2-nitrophenyl)methylene]-3-fluoro-4-methylaniline, N-[(E)-(4,5-dimethoxy-2-nitrophenyl)methylidene]-3-fluoro-4-methylaniline
| Molecular Formula | C16H15FN2O4 |
|---|---|
| Molecular Weight | 318.10 g/mol |
| LogP | 3.81012 |
| Topological Polar Surface Area | 73.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.1016 |
| Heavy Atoms | 23 |
| Complexity | 774.91583 |
Chemical Identifiers
| CAS Number | 303758-87-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N=CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)F |
Product Overview
N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline (CAS 303758-87-4), with molecular formula C16H15FN2O4 and molecular weight 318.10 g/mol. IUPAC: 1-(4,5-dimethoxy-2-nitrophenyl)-N-(3-fluoro-4-methylphenyl)methanimine.
Chemical Property Profile of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline
Property Insights of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline
The XLogP value of 3.81012 indicates that N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline. Following Lipinski's Rule of Five, N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline 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-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline?
The CAS number of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline is 303758-87-4.
What is the molecular formula of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline?
The molecular formula of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline is C16H15FN2O4.
What is the molecular weight of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline?
The molecular weight of N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline is 318.10 g/mol.
Where can I buy N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline?
You can request a quote for N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5-dimethoxy-2-nitrobenzylidene)-3-fluoro-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.