N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-6-(4-pyridinylethynyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

HCID 56597871

Basic information

Standard SMILES
Cc1cc(C)c(CNC(=O)c2cc(C#Cc3ccncc3)nc3c2cnn3C(C)C)c(=O)[nH]1
InChIKey
LVQZSFQDGDBHJW-UHFFFAOYSA-N
Molecular formula
C25H24N6O2
Average molar mass
440.5 g/mol
Monoisotopic mass
440.19607403

Names & identifiers

Preferred name
N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-6-(4-pyridinylethynyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
IUPAC
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-propan-2-yl-6-(2-pyridin-4-ylethynyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Names & synonyms

SCHEMBL1695214LVQZSFQDGDBHJW-UHFFFAOYSA-NN-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-1-(1-methylethyl)-6-(4-pyridinylethynyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

Database identifiers

PubChem CID
56597871

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
102 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
33

Related reactions

4 records

Compound notes

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