Basic information
- Standard SMILES
Cc1ccc(-n2nccc2-c2ccc3noc(-c4cccc(F)c4)c3c2)cc1- InChIKey
JPBXZNZIJJJYSP-UHFFFAOYSA-N- Molecular formula
- C23H16FN3O
- Average molar mass
- 369.4 g/mol
Names & identifiers
- Preferred name
- 3-(3-Fluoro-phenyl)-5-(2-p-tolyl-2H-pyrazol-3-yl)-benzo[c]isoxazole
- IUPAC
- 3-(3-fluorophenyl)-5-[2-(4-methylphenyl)pyrazol-3-yl]-2,1-benzoxazole
Names & synonyms
SCHEMBL15560333JPBXZNZIJJJYSP-UHFFFAOYSA-N3-(3-Fluoro-phenyl)-5-(2-p-tolyl-2H-pyrazol-3-yl)-benzo[c]isoxazole
Database identifiers
- PubChem CID
- 73053004
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
- 526
Related reactions
1 records
Compound notes
Loading…