Basic information
- Standard SMILES
CC(C)(C(=O)O)C(C)(C)c1ccc2c(cnn2-c2ccc(F)cc2)c1- InChIKey
JTDMRVXQDAJCRL-UHFFFAOYSA-N- Molecular formula
- C20H21FN2O2
- Average molar mass
- 340.4 g/mol
Names & identifiers
- Preferred name
- 3-(1-(4-fluorophenyl)-1H-indazol-5-yl)-2,2,3-trimethylbutanoic acid
- IUPAC
- 3-[1-(4-fluorophenyl)indazol-5-yl]-2,2,3-trimethylbutanoic acid
Names & synonyms
SCHEMBL1364062JTDMRVXQDAJCRL-UHFFFAOYSA-N3-(1-(4-fluorophenyl)-1H-indazol-5-yl)-2,2,3-trimethylbutanoic acid
Database identifiers
- PubChem CID
- 67006302
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 500
Related reactions
3 records
Compound notes
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