Basic information
- Standard SMILES
C[C@H](O)CONC(=O)c1ncc2cncn2c1Nc1ccc(Br)cc1F- InChIKey
QSYZJPFCSFJLLQ-VIFPVBQESA-N- Molecular formula
- C16H15BrFN5O3
- Average molar mass
- 424.22 g/mol
- Monoisotopic mass
- 423.03423
Names & identifiers
- Preferred name
- (S)-5-(4-Bromo-2-fluorophenylamino)-N-(2-hydroxy-propoxy)imidazo[1,5-a]pyrazine-6-carboxamide
- IUPAC
- 5-(4-bromo-2-fluoroanilino)-N-[(2S)-2-hydroxypropoxy]imidazo[1,5-a]pyrazine-6-carboxamide
Names & synonyms
SCHEMBL1616077SCHEMBL29683722QSYZJPFCSFJLLQ-VIFPVBQESA-N(S)-5-(4-Bromo-2-fluorophenylamino)-N-(2-hydroxy-propoxy)imidazo[1,5-a]pyrazine-6-carboxamide
Database identifiers
- PubChem CID
- 44136104
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 491
Related reactions
3 records
Compound notes
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