Basic information
- Standard SMILES
COc1ccc2nc(-c3ccc(OC)c(F)c3)c(Cl)c(Br)c2c1- InChIKey
KJIUPMQQGGLEHB-UHFFFAOYSA-N- Molecular formula
- C17H12BrClFNO2
- Average molar mass
- 396.6 g/mol
Names & identifiers
- Preferred name
- 4-Bromo-3-chloro-2-(3-fluoro-4-methoxyphenyl)-6-methoxyquinoline
- IUPAC
- 4-bromo-3-chloro-2-(3-fluoro-4-methoxyphenyl)-6-methoxyquinoline
Names & synonyms
SCHEMBL4491428KJIUPMQQGGLEHB-UHFFFAOYSA-N4-bromo-3-chloro-2-(3-fluoro-4-methoxyphenyl)-6-methoxyquinoline
Database identifiers
- PubChem CID
- 22020195
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 405
Related reactions
2 records
Compound notes
Loading…