Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate
TL;DR: Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate (CAS 7189-03-9) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1,3-diphenylpyrazole-4-carboxylate
Also Known As: Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate, ethyl 1,3-diphenylpyrazole-4-carboxylate, J3.136.761A, 1,3-Diphenyl-1H-pyrazole-4-carboxylic acid ethyl ester, 1H-Pyrazole-4-carboxylic acid, 1,3-diphenyl-, ethyl ester
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 3.716 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 764.29596 |
Chemical Identifiers
| CAS Number | 7189-03-9 |
|---|---|
| SMILES | CCOC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate (CAS 7189-03-9), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: ethyl 1,3-diphenylpyrazole-4-carboxylate.
Chemical Property Profile of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate
Property Insights of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate
The XLogP value of 3.716 indicates that Ethyl 1,3-diphenyl-1H-pyrazole-4-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 1,3-diphenyl-1H-pyrazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1,3-diphenyl-1H-pyrazole-4-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 1,3-diphenyl-1H-pyrazole-4-carboxylate?
The CAS number of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate is 7189-03-9.
What is the molecular formula of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate?
The molecular formula of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate is C18H16N2O2.
What is the molecular weight of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate?
The molecular weight of Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate is 292.12 g/mol.
Where can I buy Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate?
You can request a quote for Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1,3-diphenyl-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.