![2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol structure](/static/products/879/879449-59-9.png)
2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol
TL;DR: 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol (CAS 879449-59-9) is a chemical compound with molecular formula C22H15BrClFN2O2 and molecular weight 472.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-bromophenyl)-1H-pyrazol-5-yl]-5-[(2-chloro-6-fluorophenyl)methoxy]phenol
Also Known As: 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol, 2-(4-(4-bromophenyl)-1H-pyrazol-3-yl)-5-((2-chloro-6-fluorobenzyl)oxy)phenol, 2-[4-(4-bromophenyl)pyrazol-3-yl]-5-[(2-chloro-6-fluorophenyl)methoxy]phenol, (6Z)-6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(2-chloro-6-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one, 6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(2-chloro-6-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one
| Molecular Formula | C22H15BrClFN2O2 |
|---|---|
| Molecular Weight | 472.00 g/mol |
| LogP | 6.5833 |
| Topological Polar Surface Area | 58.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.99896 |
| Heavy Atoms | 29 |
| Complexity | 1141.6985 |
Chemical Identifiers
| CAS Number | 879449-59-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)COC2=CC(=C(C=C2)C3=C(C=NN3)C4=CC=C(C=C4)Br)O)F |
Product Overview
2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol (CAS 879449-59-9), with molecular formula C22H15BrClFN2O2 and molecular weight 472.00 g/mol. IUPAC: 2-[4-(4-bromophenyl)-1H-pyrazol-5-yl]-5-[(2-chloro-6-fluorophenyl)methoxy]phenol.
Chemical Property Profile of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol
Property Insights of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol
The XLogP value of 6.5833 indicates that 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol 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)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol 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)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol?
The CAS number of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol is 879449-59-9.
What is the molecular formula of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol?
The molecular formula of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol is C22H15BrClFN2O2.
What is the molecular weight of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol?
The molecular weight of 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol is 472.00 g/mol.
Where can I buy 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol?
You can request a quote for 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol 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)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-bromophenyl)-1H-pyrazol-3-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.