4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol
TL;DR: 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol (CAS 385401-17-2) is a chemical compound with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-6-(4-phenoxy-1H-pyrazol-5-yl)benzene-1,3-diol
Also Known As: IFLab1_003226, 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol, 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)benzene-1,3-diol, 4-ethyl-6-(4-phenoxy-1H-pyrazol-5-yl)benzene-1,3-diol, AB00113691-01
| Molecular Formula | C17H16N2O3 |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 3.8426 |
| Topological Polar Surface Area | 78.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.1161 |
| Heavy Atoms | 22 |
| Complexity | 781.8531 |
Chemical Identifiers
| CAS Number | 385401-17-2 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1O)O)C2=C(C=NN2)OC3=CC=CC=C3 |
Product Overview
4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol (CAS 385401-17-2), with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol. IUPAC: 4-ethyl-6-(4-phenoxy-1H-pyrazol-5-yl)benzene-1,3-diol.
Chemical Property Profile of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol
Property Insights of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol
The XLogP value of 3.8426 indicates that 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol. Following Lipinski's Rule of Five, 4-ethyl-6-(4-phenoxy-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-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol?
The CAS number of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol is 385401-17-2.
What is the molecular formula of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol?
The molecular formula of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol is C17H16N2O3.
What is the molecular weight of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol?
The molecular weight of 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol is 296.12 g/mol.
Where can I buy 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol?
You can request a quote for 4-ethyl-6-(4-phenoxy-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-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-6-(4-phenoxy-1H-pyrazol-3-yl)-1,3-Benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.