Basic information
- Standard SMILES
COc1cccc(CNC(=O)c2cc3cc(F)cc(Br)c3[nH]2)c1- InChIKey
LNLQHLTVYUXOBS-UHFFFAOYSA-N- Molecular formula
- C17H14BrFN2O2
- Average molar mass
- 377.2 g/mol
Names & identifiers
- Preferred name
- 7-bromo-5-fluoro-1H-indole-2-carboxylic Acid 3-methoxy-benzylamide
- IUPAC
- 7-bromo-5-fluoro-N-[(3-methoxyphenyl)methyl]-1H-indole-2-carboxamide
Names & synonyms
SCHEMBL217080LNLQHLTVYUXOBS-UHFFFAOYSA-N7-bromo-5-fluoro-1H-indole-2-carboxylic Acid 3-methoxy-benzylamide
Database identifiers
- PubChem CID
- 21014456
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 54.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 425
Related reactions
6 records
Compound notes
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