Basic information
- Standard SMILES
Fc1cccc(-c2cc(-c3cccnc3)no2)c1- InChIKey
HMLWTKLVRUPXTG-UHFFFAOYSA-N- Molecular formula
- C14H9FN2O
- Average molar mass
- 240.23 g/mol
- Monoisotopic mass
- 240.06989108
Names & identifiers
- Preferred name
- 5-(3-Fluorophenyl)-3-(pyridin-3-yl)isoxazole
- IUPAC
- 5-(3-fluorophenyl)-3-pyridin-3-yl-1,2-oxazole
Names & synonyms
SCHEMBL4325908HMLWTKLVRUPXTG-UHFFFAOYSA-N5-(3-Fluorophenyl)-3-(pyridin-3-yl)isoxazole
Database identifiers
- PubChem CID
- 44546223
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Related reactions
1 records
Compound notes
Loading…