Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate
TL;DR: Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate (CAS 618070-52-3) is a chemical compound with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-benzyl-3-phenylpyrazole-5-carboxylate
Also Known As: ethyl 1-benzyl-3-phenyl-1h-pyrazole-5-carboxylate, SALOR-INT L201405-1EA, ethyl 2-benzyl-5-phenylpyrazole-3-carboxylate, Ethyl 2-benzyl-5-phenyl-pyrazole-3-carboxylate, Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate
| Molecular Formula | C19H18N2O2 |
|---|---|
| Molecular Weight | 306.14 g/mol |
| LogP | 3.7751 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.13684 |
| Heavy Atoms | 23 |
| Complexity | 779.644 |
Chemical Identifiers
| CAS Number | 618070-52-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=NN1CC2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate (CAS 618070-52-3), with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol. IUPAC: ethyl 1-benzyl-3-phenylpyrazole-5-carboxylate.
Chemical Property Profile of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate
Property Insights of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate
The XLogP value of 3.7751 indicates that Ethyl 3-phenyl-1-(phenylmethyl)-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 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-phenyl-1-(phenylmethyl)-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 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate?
The CAS number of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate is 618070-52-3.
What is the molecular formula of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate?
The molecular formula of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate is C19H18N2O2.
What is the molecular weight of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate?
The molecular weight of Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate is 306.14 g/mol.
Where can I buy Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate?
You can request a quote for Ethyl 3-phenyl-1-(phenylmethyl)-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 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-phenyl-1-(phenylmethyl)-1H-pyrazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.