2-Oxo-2-phenylethyl 2-pyrazinecarboxylate
TL;DR: 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate (CAS 352672-48-1) is a chemical compound with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl pyrazine-2-carboxylate
Also Known As: phenacyl pyrazine-2-carboxylate, 2-oxo-2-phenylethyl 2-pyrazinecarboxylate, 2-oxo-2-phenylethyl pyrazine-2-carboxylate, BAS 06808341, Pyrazine-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester
| Molecular Formula | C13H10N2O3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.06914 |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 352672-48-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2 |
| InChIKey | PBBKMFWITHDDJO-UHFFFAOYSA-N |
Product Overview
2-Oxo-2-phenylethyl 2-pyrazinecarboxylate (CAS 352672-48-1), with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol. IUPAC: phenacyl pyrazine-2-carboxylate.
Chemical Property Profile of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate
Property Insights of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate. Following Lipinski's Rule of Five, 2-Oxo-2-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-Oxo-2-phenylethyl 2-pyrazinecarboxylate?
The CAS number of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate is 352672-48-1.
What is the molecular formula of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate?
The molecular formula of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate is C13H10N2O3.
What is the molecular weight of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate?
The molecular weight of 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate is 242.07 g/mol.
Where can I buy 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate?
You can request a quote for 2-Oxo-2-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-Oxo-2-phenylethyl 2-pyrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-phenylethyl 2-pyrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.