Basic information
- Standard SMILES
FC(F)(F)c1cccc(-c2cc(-c3cccnc3)no2)c1- InChIKey
QFMPXRJVPJXUGD-UHFFFAOYSA-N- Molecular formula
- C15H9F3N2O
- Average molar mass
- 290.24 g/mol
Names & identifiers
- Preferred name
- 3-(Pyridin-3-yl)-5-(3-(trifluoromethyl)phenyl)isoxazole
- IUPAC
- 3-pyridin-3-yl-5-[3-(trifluoromethyl)phenyl]-1,2-oxazole
Names & synonyms
3-(Pyridin-3-yl)-5-(3-(trifluoromethyl)phenyl)isoxazoleSCHEMBL4399133
Database identifiers
- PubChem CID
- 44546222
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 350
Related reactions
1 records
Compound notes
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