Basic information
- Standard SMILES
Cc1cccnc1C(=O)c1cn(Cc2cccc(Br)n2)c2ccccc2c1=O- InChIKey
WNSAJXSZUALZHT-UHFFFAOYSA-N- Molecular formula
- C22H16BrN3O2
- Average molar mass
- 434.3 g/mol
- Monoisotopic mass
- 433.04259
Names & identifiers
- Preferred name
- 1-(6-Bromo-pyridin-2-ylmethyl)-3-(3-methyl-pyridine-2-carbonyl)-1H-quinolin-4-one
- IUPAC
- 1-[(6-bromo-2-pyridinyl)methyl]-3-(3-methylpyridine-2-carbonyl)quinolin-4-one
Names & synonyms
SCHEMBL1549288WNSAJXSZUALZHT-UHFFFAOYSA-N1-(6-Bromo-pyridin-2-ylmethyl)-3-(3-methyl-pyridine-2-carbonyl)-1H-quinolin-4-one
Database identifiers
- PubChem CID
- 57754707
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 637
Related reactions
1 records
Compound notes
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