Basic information
- Standard SMILES
NC(=O)c1nccnc1NC(=O)c1cc(Br)ccc1F- InChIKey
JUPHWYXRCBFFCR-UHFFFAOYSA-N- Molecular formula
- C12H8BrFN4O2
- Average molar mass
- 339.12 g/mol
Names & identifiers
- Preferred name
- 3-(5-Bromo-2-fluorobenzoylamino)pyrazine-2-carboxamide
- IUPAC
- 3-[(5-bromo-2-fluorobenzoyl)amino]pyrazine-2-carboxamide
Names & synonyms
3-(5-bromo-2-fluorobenzoylamino)pyrazine-2-carboxamideSCHEMBL2128915JUPHWYXRCBFFCR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 57742384
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 384
Related reactions
2 records
Compound notes
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