4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline
TL;DR: 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline (CAS 355383-47-0) is a chemical compound with molecular formula C15H15BrN2O4 and molecular weight 366.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline
Also Known As: BAS 01125544, 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline, AB00089558-01, 4-bromo-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline, (4-Bromo-phenyl)-(4,5-dimethoxy-2-nitro-benzyl)-amine
| Molecular Formula | C15H15BrN2O4 |
|---|---|
| Molecular Weight | 366.02 g/mol |
| LogP | 3.9866 |
| Topological Polar Surface Area | 73.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.0215 |
| Heavy Atoms | 22 |
| Complexity | 673.9878 |
Chemical Identifiers
| CAS Number | 355383-47-0 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)CNC2=CC=C(C=C2)Br)[N+](=O)[O-])OC |
Product Overview
4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline (CAS 355383-47-0), with molecular formula C15H15BrN2O4 and molecular weight 366.02 g/mol. IUPAC: 4-bromo-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline.
Chemical Property Profile of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline
Property Insights of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline
The XLogP value of 3.9866 indicates that 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline. Following Lipinski's Rule of Five, 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline has 1 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 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline?
The CAS number of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline is 355383-47-0.
What is the molecular formula of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline?
The molecular formula of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline is C15H15BrN2O4.
What is the molecular weight of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline?
The molecular weight of 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline is 366.02 g/mol.
Where can I buy 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline?
You can request a quote for 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(4,5-dimethoxy-2-nitrobenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.