Basic information
- Standard SMILES
Cc1ccc(-c2onc3ccc(-c4ccnn4-c4ccc(F)cc4)cc23)cc1- InChIKey
GOVRVAYQAZUGQB-UHFFFAOYSA-N- Molecular formula
- C23H16FN3O
- Average molar mass
- 369.4 g/mol
Names & identifiers
- Preferred name
- 5-[2-(4-Fluoro-phenyl)-2H--pyrazol-3-yl]-3-p-tolyl-benzo[c]isoxazole
- IUPAC
- 5-[2-(4-fluorophenyl)pyrazol-3-yl]-3-(4-methylphenyl)-2,1-benzoxazole
Names & synonyms
SCHEMBL17075414GOVRVAYQAZUGQB-UHFFFAOYSA-N5-[2-(4-Fluoro-phenyl)-2H--pyrazol-3-yl]-3-p-tolyl-benzo[c]isoxazole
Database identifiers
- PubChem CID
- 73053000
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 518
Related reactions
1 records
Compound notes
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