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Basic information
- Standard SMILES
COc1ccc(-c2cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)c3cnn(C(C)C)c3n2)cc1- InChIKey
VQFJTVSOZHCIFN-UHFFFAOYSA-N- Molecular formula
- C25H27N5O3
- Average molar mass
- 445.5 g/mol
Names & identifiers
- Preferred name
- N-[(4,6-Dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-6-[4-(methyloxy)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
- IUPAC
- N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
Names & synonyms
SCHEMBL10254853VQFJTVSOZHCIFN-UHFFFAOYSA-NBDBM325897US9637472, Compound A-103US10273223, Compound A-103N-[(4,6-Dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-6-[4-(methyloxy)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Database identifiers
- PubChem CID
- 56599079
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 815
Related reactions
2 records
Compound notes
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