2-Oxo-1-methyl-3-isopropylpyrazine
TL;DR: 2-Oxo-1-methyl-3-isopropylpyrazine (CAS 78210-68-1) is a chemical compound with molecular formula C8H12N2O and molecular weight 152.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-propan-2-ylpyrazin-2-one
Also Known As: 2-Oxo-1-methyl-3-isopropylpyrazine, 1-methyl-3-propan-2-ylpyrazin-2-one, 3-Isopropyl-1-methyl-2(1H)-pyrazinone, 3-Isopropyl-1-methyl-2(1H)-pyrazinone #, Pyrazine, 2-oxo-1-methyl-3-(1-methylethyl)
| Molecular Formula | C8H12N2O |
|---|---|
| Molecular Weight | 152.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.09496 |
| Heavy Atoms | 11 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 78210-68-1 |
|---|---|
| SMILES | CC(C)C1=NC=CN(C1=O)C |
| InChIKey | DPPMIAOELVJMCJ-UHFFFAOYSA-N |
Product Overview
2-Oxo-1-methyl-3-isopropylpyrazine (CAS 78210-68-1), with molecular formula C8H12N2O and molecular weight 152.09 g/mol. IUPAC: 1-methyl-3-propan-2-ylpyrazin-2-one.
Chemical Property Profile of 2-Oxo-1-methyl-3-isopropylpyrazine
Property Insights of 2-Oxo-1-methyl-3-isopropylpyrazine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-1-methyl-3-isopropylpyrazine. With a topological polar surface area (TPSA) of 32.7 Ų, 2-Oxo-1-methyl-3-isopropylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-1-methyl-3-isopropylpyrazine has 0 hydrogen bond donor(s) and 2 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-1-methyl-3-isopropylpyrazine?
The CAS number of 2-Oxo-1-methyl-3-isopropylpyrazine is 78210-68-1.
What is the molecular formula of 2-Oxo-1-methyl-3-isopropylpyrazine?
The molecular formula of 2-Oxo-1-methyl-3-isopropylpyrazine is C8H12N2O.
What is the molecular weight of 2-Oxo-1-methyl-3-isopropylpyrazine?
The molecular weight of 2-Oxo-1-methyl-3-isopropylpyrazine is 152.09 g/mol.
Where can I buy 2-Oxo-1-methyl-3-isopropylpyrazine?
You can request a quote for 2-Oxo-1-methyl-3-isopropylpyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-1-methyl-3-isopropylpyrazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1-methyl-3-isopropylpyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.