ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate
TL;DR: ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate (CAS 7189-10-8) is a chemical compound with molecular formula C18H15ClN2O2 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-chlorophenyl)-3-phenylpyrazole-4-carboxylate
Also Known As: ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate, AE-842/32631014, ethyl 1-(4-chlorophenyl)-3-phenylpyrazole-4-carboxylate
| Molecular Formula | C18H15ClN2O2 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 4.3694 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.0822 |
| Heavy Atoms | 23 |
| Complexity | 810.7978 |
Chemical Identifiers
| CAS Number | 7189-10-8 |
|---|---|
| SMILES | CCOC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)Cl |
Product Overview
ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate (CAS 7189-10-8), with molecular formula C18H15ClN2O2 and molecular weight 326.08 g/mol. IUPAC: ethyl 1-(4-chlorophenyl)-3-phenylpyrazole-4-carboxylate.
Chemical Property Profile of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate
Property Insights of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate
The XLogP value of 4.3694 indicates that ethyl 1-(4-chlorophenyl)-3-phenyl-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-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 1-(4-chlorophenyl)-3-phenyl-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-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate?
The CAS number of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate is 7189-10-8.
What is the molecular formula of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate?
The molecular formula of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate is C18H15ClN2O2.
What is the molecular weight of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate?
The molecular weight of ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate is 326.08 g/mol.
Where can I buy ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate?
You can request a quote for ethyl 1-(4-chlorophenyl)-3-phenyl-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-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(4-chlorophenyl)-3-phenyl-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.