Basic information
- Standard SMILES
Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(S(=O)(=O)N(C)C)cc3)nc3c2c(C)nn3C(C)C)c(=O)[nH]1- InChIKey
YJGGPWSQBLSTLJ-UHFFFAOYSA-N- Molecular formula
- C27H32N6O4S
- Average molar mass
- 536.6 g/mol
Names & identifiers
- Preferred name
- 6-{4-[(Dimethylamino)sulfonyl]phenyl}-N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-3-methyl-1-(1-methylethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
- IUPAC
- N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-[4-(dimethylsulfamoyl)phenyl]-3-methyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
Names & synonyms
SCHEMBL10256835YJGGPWSQBLSTLJ-UHFFFAOYSA-N6-{4-[(Dimethylamino)sulfonyl]phenyl}-N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-3-methyl-1-(1-methylethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Database identifiers
- PubChem CID
- 68079233
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 1,090
Related reactions
2 records
Compound notes
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