Basic information
- Standard SMILES
COC(=O)c1cc2cnn(-c3ccc(F)cc3)c2cc1C- InChIKey
PSNWYQPJCMKDQR-UHFFFAOYSA-N- Molecular formula
- C16H13FN2O2
- Average molar mass
- 284.28 g/mol
Names & identifiers
- Preferred name
- Methyl 1-(4-fluorophenyl)-6-methyl-1H-indazole-5-carboxylate
- IUPAC
- methyl 1-(4-fluorophenyl)-6-methylindazole-5-carboxylate
Names & synonyms
SCHEMBL1361914PSNWYQPJCMKDQR-UHFFFAOYSA-NMethyl 1-(4-fluorophenyl)-6-methyl-1H-indazole-5-carboxylate
Database identifiers
- PubChem CID
- 67005487
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
Related reactions
3 records
Compound notes
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