Basic information
- CAS
34580-66-0- Standard SMILES
CC(=O)COc1nn(-c2cccc(C(F)(F)F)c2)c2ncccc12- InChIKey
ASTCNIALLSQLQN-UHFFFAOYSA-N- Molecular formula
- C16H12F3N3O2
- Average molar mass
- 335.28 g/mol
- Monoisotopic mass
- 335.08816112
Names & identifiers
- Preferred name
- 2-Propanone, 1-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-
- IUPAC
- 1-[1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridin-3-yl]oxypropan-2-one
- English name
- 1-[[1-[m-(Trifluoromethyl)phenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]oxy]-2-propanone
- Molecular weight
- 0
Names & synonyms
34580-66-0ITF 1028BRN 07097001-((1-(alpha,alpha,alpha-Trifluoro-m-tolyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-2-propanone2-Propanone, 1-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-2-Propanone, 1-((1-(alpha,alpha,alpha-trifluoro-m-tolyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-RefChem:2660102-Propanone, 1-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-(9CI)1-({1-[3-(trifluoromethyl)phenyl]-1h-pyrazolo[3,4-b]pyridin-3-yl}oxy)propan-2-one1-((1-(3-(Trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)oxy)propan-2-oneDTXSID909560871-[[1-[m-(Trifluoromethyl)phenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]oxy]-2-propanone
Show more names
ITF-1028
DB-2592871-[[1-[M-(trifluoromethyl)phenyl ]-1H-pyrazolo[3,4-b]pyridin-3-yl ]oxy]-2-propanone
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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