Basic information
- Standard SMILES
C=Cc1nc2c(Cl)cccc2cc1C(C)N1C(=O)c2ccccc2C1=O- InChIKey
JJDNRLQGBAQYGJ-UHFFFAOYSA-N- Molecular formula
- C21H15ClN2O2
- Average molar mass
- 362.8 g/mol
- Monoisotopic mass
- 362.0822054
Names & identifiers
- Preferred name
- 2-[1-(8-Chloro-2-ethenylquinolin-3-yl)ethyl]isoindole-1,3-dione
- IUPAC
- 2-[1-(8-chloro-2-ethenylquinolin-3-yl)ethyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL4179040
Database identifiers
- PubChem CID
- 68944684
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 50.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 571
Related reactions
2 records
Compound notes
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