Basic information
- CAS
937598-58-8- Standard SMILES
Cc1cc(C(=O)NN)c2c(C)nn(-c3ccc(F)cc3)c2n1- InChIKey
ZNYDSCBVZAYJJZ-UHFFFAOYSA-N- Molecular formula
- C15H14FN5O
- Average molar mass
- 299.3 g/mol
- Monoisotopic mass
- 299.11823825
Names & identifiers
- Preferred name
- 1-(4-fluorophenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide
- IUPAC
- 1-(4-fluorophenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carbohydrazide
- English name
- 1-(4-Fluorophenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide
- Molecular formula
- C15H14FN5O
- Molecular weight
- 299.3
Names & synonyms
1-(4-fluorophenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide937598-58-81-(4-fluorophenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carbohydrazideMFCD08558225DTXSID001126201SBB023824STK3508791-(4-fluorophenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carbohydrazide1-(4-fluorophenyl)-3,6-dimethylpyrazolo[5,4-b]pyridine-4-carbohydrazideAKOS000313361CS-0280381EN300-230765
Show more names
1H-Pyrazolo[3,4-b]pyridine-4-carboxylic acid, 1-(4-fluorophenyl)-3,6-dimethyl-, hydrazide
1-(4-Fluorophenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid hydrazide
Database identifiers
- CAS
937598-58-8- PubChem CID
- 19616622
- DTXSID
DTXSID001126201
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 415
Physicochemical properties
- Density
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- pka
- 11.22 · 11.22±0.30(Predicted)
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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