ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
TL;DR: ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate (CAS 618070-37-4) is a chemical compound with molecular formula C20H16BrFN2O3 and molecular weight 430.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-3-(4-fluorophenyl)pyrazole-5-carboxylate
Also Known As: ET 1-(2-(4-BROMOPHENYL)-2-OXOETHYL)-3-(4-FLUOROPHENYL)-1H-PYRAZOLE-5-CARBOXYLATE, Ethyl 2-[2-(4-bromophenyl)-2-oxo-ethyl]-5-(4-fluorophenyl)pyrazole-3-carboxylate, ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-(4-fluorophenyl)pyrazole-3-carboxylate, 632-207-2, RefChem:591289
| Molecular Formula | C20H16BrFN2O3 |
|---|---|
| Molecular Weight | 430.03 g/mol |
| LogP | 4.5113 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.03284 |
| Heavy Atoms | 27 |
| Complexity | 965.89685 |
Chemical Identifiers
| CAS Number | 618070-37-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=NN1CC(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)F |
Product Overview
ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate (CAS 618070-37-4), with molecular formula C20H16BrFN2O3 and molecular weight 430.03 g/mol. IUPAC: ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-3-(4-fluorophenyl)pyrazole-5-carboxylate.
Chemical Property Profile of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
Property Insights of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
The XLogP value of 4.5113 indicates that ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate. Following Lipinski's Rule of Five, ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate has 0 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 ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The CAS number of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is 618070-37-4.
What is the molecular formula of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The molecular formula of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is C20H16BrFN2O3.
What is the molecular weight of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The molecular weight of ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is 430.03 g/mol.
Where can I buy ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
You can request a quote for ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ET 1-(2-(4-Bromophenyl)-2-oxoethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.