N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline
TL;DR: N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline (CAS 306732-01-4) is a chemical compound with molecular formula C15H13BrF3NO2 and molecular weight 375.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-bromo-2-methoxyphenyl)methyl]-4-(trifluoromethoxy)aniline
Also Known As: N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline, N-[(4-bromo-2-methoxyphenyl)methyl]-4-(trifluoromethoxy)aniline, AA-768/32245022, [(4-bromo-2-methoxyphenyl)methyl][4-(trifluoromethoxy)phenyl]amine, N-(4-bromo-2-methoxybenzyl)-N-[4-(trifluoromethoxy)phenyl]amine
| Molecular Formula | C15H13BrF3NO2 |
|---|---|
| Molecular Weight | 375.01 g/mol |
| LogP | 4.9684 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.00818 |
| Heavy Atoms | 22 |
| Complexity | 629.6749 |
Chemical Identifiers
| CAS Number | 306732-01-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)Br)CNC2=CC=C(C=C2)OC(F)(F)F |
Product Overview
N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline (CAS 306732-01-4), with molecular formula C15H13BrF3NO2 and molecular weight 375.01 g/mol. IUPAC: N-[(4-bromo-2-methoxyphenyl)methyl]-4-(trifluoromethoxy)aniline.
Chemical Property Profile of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline
Property Insights of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline
The XLogP value of 4.9684 indicates that N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline 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-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline 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-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline?
The CAS number of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline is 306732-01-4.
What is the molecular formula of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline?
The molecular formula of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline is C15H13BrF3NO2.
What is the molecular weight of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline?
The molecular weight of N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline is 375.01 g/mol.
Where can I buy N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline?
You can request a quote for N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-2-methoxybenzyl)-4-(trifluoromethoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.