Basic information
- Standard SMILES
CC(C)CC(=O)c1ccc2c(cnn2-c2ccc(F)cc2)c1- InChIKey
IEMBKRKVYMYCFJ-UHFFFAOYSA-N- Molecular formula
- C18H17FN2O
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.13249133
Names & identifiers
- Preferred name
- 1-(1-(4-fluorophenyl)-1H-indazol-5-yl)-3-methylbutan-1-one
- IUPAC
- 1-[1-(4-fluorophenyl)indazol-5-yl]-3-methylbutan-1-one
Names & synonyms
SCHEMBL1361900IEMBKRKVYMYCFJ-UHFFFAOYSA-N1-(1-(4-fluorophenyl)-1H-indazol-5-yl)-3-methylbutan-1-one
Database identifiers
- PubChem CID
- 67005483
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 393
Related reactions
3 records
Compound notes
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