Basic information
- Standard SMILES
Cc1cc(C)c(CNC(=O)c2cc(Nc3ccc(C(N)=O)cc3)nc3c2cnn3C(C)C)c(=O)[nH]1- InChIKey
KWPKXQFYRMVTLS-UHFFFAOYSA-N- Molecular formula
- C25H27N7O3
- Average molar mass
- 473.5 g/mol
- Monoisotopic mass
- 473.21753775
Names & identifiers
- Preferred name
- 6-{[4-(Aminocarbonyl)phenyl]amino}-N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
- IUPAC
- 6-(4-carbamoylanilino)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
Names & synonyms
SCHEMBL10255873KWPKXQFYRMVTLS-UHFFFAOYSA-N6-{[4-(Aminocarbonyl)phenyl]amino}-N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Database identifiers
- PubChem CID
- 56597161
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 907
Related reactions
2 records
Compound notes
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