4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol
TL;DR: 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol (CAS 294653-57-9) is a chemical compound with molecular formula C16H13FN2O2 and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol
Also Known As: 4-(4-(4-FLUOROPHENYL)-5-METHYL-1H-PYRAZOL-3-YL)-1,3-BENZENEDIOL, 4-[4-(4-fluorophenyl)-5-methylpyrazol-3-yl]benzene-1,3-diol, 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)benzene-1,3-diol, 4-[4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-1,3-benzenediol, (4E)-4-[4-(4-fluorophenyl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one
| Molecular Formula | C16H13FN2O2 |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 69.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.0961 |
| Heavy Atoms | 21 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 294653-57-9 |
|---|---|
| SMILES | CC1=C(C(=NN1)C2=C(C=C(C=C2)O)O)C3=CC=C(C=C3)F |
| InChIKey | SLHWDVOAHKLWKF-UHFFFAOYSA-N |
Product Overview
4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol (CAS 294653-57-9), with molecular formula C16H13FN2O2 and molecular weight 284.10 g/mol. IUPAC: 4-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol.
Chemical Property Profile of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol
Property Insights of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol
The XLogP value of 3.3 indicates that 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol. Following Lipinski's Rule of Five, 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol has 3 hydrogen bond donor(s) and 4 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-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol?
The CAS number of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol is 294653-57-9.
What is the molecular formula of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol?
The molecular formula of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol is C16H13FN2O2.
What is the molecular weight of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol?
The molecular weight of 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol is 284.10 g/mol.
Where can I buy 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol?
You can request a quote for 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(4-Fluorophenyl)-5-methyl-1H-pyrazol-3-yl)-1,3-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.