Basic information
- Standard SMILES
Cn1cc(Br)cc(Nc2cnccn2)c1=O- InChIKey
VXNHPGPHYKKWIG-UHFFFAOYSA-N- Molecular formula
- C10H9BrN4O
- Average molar mass
- 281.11 g/mol
- Monoisotopic mass
- 279.99597
Names & identifiers
- Preferred name
- 5-Bromo-1-methyl-3-(pyrazin-2-ylamino)pyridin-2(1H)-one
- IUPAC
- 5-bromo-1-methyl-3-(pyrazin-2-ylamino)pyridin-2-one
Names & synonyms
SCHEMBL14917675VXNHPGPHYKKWIG-UHFFFAOYSA-NDB-1073665-Bromo-1-methyl-3-(pyrazin-2-ylamino)pyridin-2(1H)-one1433859-44-9
Database identifiers
- PubChem CID
- 86684085
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 353
Related reactions
13 records
Compound notes
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