1-Phenyl-2-pyrazin-2-yl ethanone
TL;DR: 1-Phenyl-2-pyrazin-2-yl ethanone (CAS 40061-45-8) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-pyrazin-2-ylethanone
Also Known As: 1-phenyl-2-pyrazin-2-ylethanone, phenacylpyrazine, Phenacyl pyrazine, 2-Phenacylpyrazine, 1-phenyl-2-(pyrazin-2-yl)ethanone
| Molecular Formula | C12H10N2O |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.07932 |
| Heavy Atoms | 15 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 40061-45-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC2=NC=CN=C2 |
| InChIKey | WUYTZBFFXRNJSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-2-pyrazin-2-yl ethanone (CAS 40061-45-8), with molecular formula C12H10N2O and molecular weight 198.08 g/mol. IUPAC: 1-phenyl-2-pyrazin-2-ylethanone.
Chemical Property Profile of 1-Phenyl-2-pyrazin-2-yl ethanone
Property Insights of 1-Phenyl-2-pyrazin-2-yl ethanone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-2-pyrazin-2-yl ethanone. With a topological polar surface area (TPSA) of 42.9 Ų, 1-Phenyl-2-pyrazin-2-yl ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-pyrazin-2-yl ethanone 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 1-Phenyl-2-pyrazin-2-yl ethanone?
The CAS number of 1-Phenyl-2-pyrazin-2-yl ethanone is 40061-45-8.
What is the molecular formula of 1-Phenyl-2-pyrazin-2-yl ethanone?
The molecular formula of 1-Phenyl-2-pyrazin-2-yl ethanone is C12H10N2O.
What is the molecular weight of 1-Phenyl-2-pyrazin-2-yl ethanone?
The molecular weight of 1-Phenyl-2-pyrazin-2-yl ethanone is 198.08 g/mol.
Where can I buy 1-Phenyl-2-pyrazin-2-yl ethanone?
You can request a quote for 1-Phenyl-2-pyrazin-2-yl ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-pyrazin-2-yl ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-pyrazin-2-yl ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.