![2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol structure](/static/products/879/879457-48-4.png)
2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol
TL;DR: 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol (CAS 879457-48-4) is a chemical compound with molecular formula C17H12BrF3N2O2 and molecular weight 412.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-bromophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]-5-methoxyphenol
Also Known As: 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol, 2-(4-(4-bromophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl)-5-methoxyphenol, 2-[4-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-3-yl]-5-methoxyphenol, 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxy-phenol, 2-[4-(4-bromophenyl)-5-(trifluoromethyl)-1~{H}-pyrazol-3-yl]-5-methoxy-phenol
| Molecular Formula | C17H12BrF3N2O2 |
|---|---|
| Molecular Weight | 412.00 g/mol |
| LogP | 5.2392 |
| Topological Polar Surface Area | 58.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.00342 |
| Heavy Atoms | 25 |
| Complexity | 905.2467 |
Chemical Identifiers
| CAS Number | 879457-48-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NNC(=C2C3=CC=C(C=C3)Br)C(F)(F)F)O |
Product Overview
2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol (CAS 879457-48-4), with molecular formula C17H12BrF3N2O2 and molecular weight 412.00 g/mol. IUPAC: 2-[4-(4-bromophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]-5-methoxyphenol.
Chemical Property Profile of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol
Property Insights of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol
The XLogP value of 5.2392 indicates that 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.14 Ų, 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol?
The CAS number of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol is 879457-48-4.
What is the molecular formula of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol?
The molecular formula of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol is C17H12BrF3N2O2.
What is the molecular weight of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol?
The molecular weight of 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol is 412.00 g/mol.
Where can I buy 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol?
You can request a quote for 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-methoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.