4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol
TL;DR: 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol (CAS 329778-55-4) 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.
4-bromo-2-methoxy-6-[[4-(trifluoromethyl)anilino]methyl]phenol
Also Known As: 4-bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol, 4-bromo-2-methoxy-6-[[4-(trifluoromethyl)anilino]methyl]phenol, 4-bromo-2-methoxy-6-({[4-(trifluoromethyl)phenyl]amino}methyl)phenol
| Molecular Formula | C15H13BrF3NO2 |
|---|---|
| Molecular Weight | 375.01 g/mol |
| LogP | 4.7942 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.00818 |
| Heavy Atoms | 22 |
| Complexity | 657.0725 |
Chemical Identifiers
| CAS Number | 329778-55-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)CNC2=CC=C(C=C2)C(F)(F)F)Br |
Product Overview
4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol (CAS 329778-55-4), with molecular formula C15H13BrF3NO2 and molecular weight 375.01 g/mol. IUPAC: 4-bromo-2-methoxy-6-[[4-(trifluoromethyl)anilino]methyl]phenol.
Chemical Property Profile of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol
Property Insights of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol
The XLogP value of 4.7942 indicates that 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol has 2 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 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol?
The CAS number of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol is 329778-55-4.
What is the molecular formula of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol?
The molecular formula of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol is C15H13BrF3NO2.
What is the molecular weight of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol?
The molecular weight of 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol is 375.01 g/mol.
Where can I buy 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol?
You can request a quote for 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-methoxy-6-{[4-(trifluoromethyl)anilino]methyl}benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.