Basic information
- CAS
1011398-23-4- Standard SMILES
O=C(O)c1cc(-c2ccco2)nc2c1cnn2-c1ccccc1F- InChIKey
OYEKDHZVXUPMFI-UHFFFAOYSA-N- Molecular formula
- C17H10FN3O3
- Average molar mass
- 323.28 g/mol
Names & identifiers
- Preferred name
- 1-(2-fluorophenyl)-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
- IUPAC
- 1-(2-fluorophenyl)-6-(furan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
- English name
- 1-(2-fluorophenyl)-6-(2-furyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
- Molecular formula
- C17H10FN3O3
- Molecular weight
- 323.28
Names & synonyms
1011398-23-41-(2-fluorophenyl)-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid1-(2-Fluorophenyl)-6-(2-furyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid1-(2-fluorophenyl)-6-(furan-2-yl)pyrazolo[3,4-b]pyridine-4-carboxylic acidMFCD09473409C17H10FN3O3LQB39823SBB024777STK351727AKOS0051677081-(2-Fluorophenyl)-6-(2-furyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acidCS-0241093
Show more names
1H-Pyrazolo[3,4-b]pyridine-4-carboxylic acid, 1-(2-fluorophenyl)-6-(2-furanyl)-
EN300-2313631-(2-fluorophenyl)-6-(2-furyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid1-(2-fluorophenyl)-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylicacid
Database identifiers
- CAS
1011398-23-4
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 480
Physicochemical properties
- Boiling point
- 477.9 · 477.9±45.0 °C(Predicted)
- Density
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- pka
- 2.14 · 2.14±0.30(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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