Basic information
- Standard SMILES
COc1ccc(-n2nccc2-c2ccc3noc(-c4cccc(F)c4)c3c2)cc1- InChIKey
OIHDICZQACCKAO-UHFFFAOYSA-N- Molecular formula
- C23H16FN3O2
- Average molar mass
- 385.4 g/mol
Names & identifiers
- Preferred name
- 3-(3-Fluoro-phenyl)-5-[2-(4-methoxy-phenyl)-2H-pyrazol-3-yl]-benzo[c]isoxazole
- IUPAC
- 3-(3-fluorophenyl)-5-[2-(4-methoxyphenyl)pyrazol-3-yl]-2,1-benzoxazole
Names & synonyms
SCHEMBL17075416OIHDICZQACCKAO-UHFFFAOYSA-N3-(3-Fluoro-phenyl)-5-[2-(4-methoxy-phenyl)-2H-pyrazol-3-yl]-benzo[c]isoxazole
Database identifiers
- PubChem CID
- 73053151
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 544
Related reactions
1 records
Linked notes
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