Basic information
- Standard SMILES
O=C(O)c1ccc(C(=O)Nc2nn(Cc3cccc(Cl)c3)c3ccc(F)cc23)cc1- InChIKey
MCTAHGVNLVXAQR-UHFFFAOYSA-N- Molecular formula
- C22H15ClFN3O3
- Average molar mass
- 423.8 g/mol
Names & identifiers
- Preferred name
- 4-[[1-[(3-Chlorophenyl)methyl]-5-fluoroindazol-3-yl]carbamoyl]benzoic acid
- IUPAC
- 4-[[1-[(3-chlorophenyl)methyl]-5-fluoroindazol-3-yl]carbamoyl]benzoic acid
Names & synonyms
SCHEMBL957619
Database identifiers
- PubChem CID
- 24955211
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 631
Related reactions
1 records
Compound notes
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