N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline
TL;DR: N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline (CAS 332108-16-4) is a chemical compound with molecular formula C16H17BrFNO2 and molecular weight 353.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline
Also Known As: BAS 01125210, AB00089581-01, N-(5-bromo-2,4-dimethoxybenzyl)-4-fluoro-2-methylaniline, N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline, (5-Bromo-2,4-dimethoxy-benzyl)-(4-fluoro-2-methyl-phenyl)-amine
| Molecular Formula | C16H17BrFNO2 |
|---|---|
| Molecular Weight | 353.04 g/mol |
| LogP | 4.52592 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.04266 |
| Heavy Atoms | 21 |
| Complexity | 646.41437 |
Chemical Identifiers
| CAS Number | 332108-16-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)F)NCC2=CC(=C(C=C2OC)OC)Br |
Product Overview
N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline (CAS 332108-16-4), with molecular formula C16H17BrFNO2 and molecular weight 353.04 g/mol. IUPAC: N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline.
Chemical Property Profile of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline
Property Insights of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline
The XLogP value of 4.52592 indicates that N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline has 1 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-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline?
The CAS number of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline is 332108-16-4.
What is the molecular formula of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline?
The molecular formula of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline is C16H17BrFNO2.
What is the molecular weight of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline?
The molecular weight of N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline is 353.04 g/mol.
Where can I buy N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline?
You can request a quote for N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-fluoro-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.