5-Methylpyrazin-2(1H)-one - CAS 20721-17-9
Catalog: |
BB016217 |
Product Name: |
5-Methylpyrazin-2(1H)-one |
CAS: |
20721-17-9 |
Synonyms: |
5-methyl-1H-pyrazin-2-one; 5-methyl-1H-pyrazin-2-one |
IUPAC Name: | 5-methyl-1H-pyrazin-2-one |
Description: | 5-Methylpyrazin-2(1H)-one (CAS# 20721-17-9) is a useful synthetic intermediate. it is a derivative of 2-Hydroxypyrazine (H952710) which is used in the synthesis of potential antioxidants. 2-Hydroxypyrazine (H952710) is also used in the preparation of antibacterial agents as 2-substituted pyrazine derivatives. |
Molecular Weight: | 110.11 |
Molecular Formula: | C5H6N2O |
Canonical SMILES: | CC1=CNC(=O)C=N1 |
InChI: | InChI=1S/C5H6N2O/c1-4-2-7-5(8)3-6-4/h2-3H,1H3,(H,7,8) |
InChI Key: | MJJNWPBBFIRYCW-UHFFFAOYSA-N |
Boiling Point: | 376.2 °C at 760 mmHg |
Density: | 1.22 g/cm3 |
MDL: | MFCD01693937 |
LogP: | 0.49060 |
Publication Number | Title | Priority Date |
WO-2020115501-A1 | Pharmaceutical compounds and their use as inhibitors of ubiquitin specific protease 19 (usp19) | 20181206 |
CN-113365696-A | Pharmaceutical compounds and their use as inhibitors of ubiquitin-specific protease 19(USP19) | 20181206 |
EP-3890829-A1 | Pharmaceutical compounds and their use as inhibitors of ubiquitin specific protease 19 (usp19) | 20181206 |
KR-20210102285-A | Use as pharmaceutical compounds and inhibitors of ubiquitin-specific protease 19 (USP19) | 20181206 |
WO-2019150119-A1 | 4-hydroxypiperidine derivatives and their use as inhibitors of ubiquitin specific protease 19 (usp19) | 20180131 |
PMID | Publication Date | Title | Journal |
14718580 | 20040401 | Novel 2',6'-dimethyl-L-tyrosine-containing pyrazinone opioid mimetic mu-agonists with potent antinociceptive activity in mice | The Journal of pharmacology and experimental therapeutics |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 110.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 110.048012819 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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Related Functional Groups
Pyrazines
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