ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
TL;DR: ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate (CAS 956203-07-9) is a chemical compound with molecular formula C20H19FN2O2 and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)pyrazole-5-carboxylate
Also Known As: AB00722271-01, ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate, ethyl 2-(2,4-dimethylphenyl)-5-(4-fluorophenyl)pyrazole-3-carboxylate
| Molecular Formula | C20H19FN2O2 |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 4.47194 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.14307 |
| Heavy Atoms | 25 |
| Complexity | 913.9456 |
Chemical Identifiers
| CAS Number | 956203-07-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=C(C=C3)F |
Product Overview
ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate (CAS 956203-07-9), with molecular formula C20H19FN2O2 and molecular weight 338.14 g/mol. IUPAC: ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)pyrazole-5-carboxylate.
Chemical Property Profile of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
Property Insights of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate
The XLogP value of 4.47194 indicates that ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate has 0 hydrogen bond donor(s) and 3 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 ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The CAS number of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is 956203-07-9.
What is the molecular formula of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The molecular formula of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is C20H19FN2O2.
What is the molecular weight of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
The molecular weight of ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate is 338.14 g/mol.
Where can I buy ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
You can request a quote for ethyl 1-(2,4-dimethylphenyl)-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 ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(2,4-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.