Basic information
- Standard SMILES
C[C@@H](NC(=O)c1c[nH]c2ncc(-c3nn(C)c4cc(F)ccc34)nc12)C(C)(C)F- InChIKey
JQKYWEPNXNZDLC-SNVBAGLBSA-N- Molecular formula
- C20H20F2N6O
- Average molar mass
- 398.4 g/mol
Names & identifiers
- Preferred name
- 2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid ((R)-2-fluoro-1,2-dimethyl-propyl)-amide
- IUPAC
- N-[(2R)-3-fluoro-3-methylbutan-2-yl]-2-(6-fluoro-1-methylindazol-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
Names & synonyms
SCHEMBL14746837JQKYWEPNXNZDLC-SNVBAGLBSA-N2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid ((R)-2-fluoro-1,2-dimethyl-propyl)-amide
Database identifiers
- PubChem CID
- 71285960
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 88.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 622
Related reactions
1 records
Compound notes
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