Basic information
- Standard SMILES
COc1nn(-c2cnc3[nH]cc(C(=O)NC(C)(C)CO)c3n2)c2ccccc12- InChIKey
BSXKUXFFBFNRSG-UHFFFAOYSA-N- Molecular formula
- C19H20N6O3
- Average molar mass
- 380.4 g/mol
Names & identifiers
- Preferred name
- 2-(3-methoxy-indazol-1-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (2-hydroxy-1,1-dimethyl-ethyl)amide
- IUPAC
- N-(1-hydroxy-2-methylpropan-2-yl)-2-(3-methoxyindazol-1-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
Names & synonyms
SCHEMBL14744466BSXKUXFFBFNRSG-UHFFFAOYSA-N2-(3-methoxy-indazol-1-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (2-hydroxy-1,1-dimethyl-ethyl)amide
Database identifiers
- PubChem CID
- 71283991
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 576
Related reactions
1 records
Compound notes
Loading…