3-Butyryl-4-chloro-8-phthalimidoquinoline
Basic information
- Standard SMILES
CCCC(=O)c1cnc2c(N3C(=O)c4ccccc4C3=O)cccc2c1Cl- InChIKey
MQAXZUAQCAHUTG-UHFFFAOYSA-N- Molecular formula
- C21H15ClN2O3
- Average molar mass
- 378.8 g/mol
Names & identifiers
- Preferred name
- 3-Butyryl-4-chloro-8-phthalimidoquinoline
- IUPAC
- 2-(3-butanoyl-4-chloroquinolin-8-yl)isoindole-1,3-dione
Names & synonyms
SCHEMBL9349264MQAXZUAQCAHUTG-UHFFFAOYSA-N3-butyryl-4-chloro-8-phthalimidoquinoline
Database identifiers
- PubChem CID
- 10091085
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 601
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Related reactions
4 records
Compound notes
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