Basic information
- Standard SMILES
COc1cc(OC)cc(-c2nn(C)c3[nH]c(=O)cc(C)c23)c1- InChIKey
UORRVNNABUGIMI-UHFFFAOYSA-N- Molecular formula
- C16H17N3O3
- Average molar mass
- 299.32 g/mol
Names & identifiers
- Preferred name
- 3-(3,5-dimethoxyphenyl)-1,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
- IUPAC
- 3-(3,5-dimethoxyphenyl)-1,4-dimethyl-7H-pyrazolo[5,4-b]pyridin-6-one
Names & synonyms
SCHEMBL1915304UORRVNNABUGIMI-UHFFFAOYSA-N3-(3,5-dimethoxyphenyl)-1,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
Database identifiers
- PubChem CID
- 136376516
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 456
Related reactions
2 records
Compound notes
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