2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate
TL;DR: 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate (CAS 516467-22-4) is a chemical compound with molecular formula C21H18N2O3 and molecular weight 346.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] pyrazine-2-carboxylate
Also Known As: 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate, 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl pyrazine-2-carboxylate, [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] pyrazine-2-carboxylate
| Molecular Formula | C21H18N2O3 |
|---|---|
| Molecular Weight | 346.13 g/mol |
| LogP | 3.87444 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.13174 |
| Heavy Atoms | 26 |
| Complexity | 924.5009 |
Chemical Identifiers
| CAS Number | 516467-22-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=NC=CN=C3)C |
Product Overview
2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate (CAS 516467-22-4), with molecular formula C21H18N2O3 and molecular weight 346.13 g/mol. IUPAC: [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] pyrazine-2-carboxylate.
Chemical Property Profile of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate
Property Insights of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate
The XLogP value of 3.87444 indicates that 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate has 0 hydrogen bond donor(s) and 5 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 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate?
The CAS number of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate is 516467-22-4.
What is the molecular formula of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate?
The molecular formula of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate is C21H18N2O3.
What is the molecular weight of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate?
The molecular weight of 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate is 346.13 g/mol.
Where can I buy 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate?
You can request a quote for 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenyl)-2-oxo-1-phenylethyl 2-pyrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.