2-[1-[8-Chloro-2-(1,2-dihydroxyethyl)quinolin-3-yl]ethyl]isoindole-1,3-dione
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Basic information
- Standard SMILES
CC(c1cc2cccc(Cl)c2nc1C(O)CO)N1C(=O)c2ccccc2C1=O- InChIKey
UPWKFLQAJAADLN-UHFFFAOYSA-N- Molecular formula
- C21H17ClN2O4
- Average molar mass
- 396.8 g/mol
Names & identifiers
- Preferred name
- 2-[1-[8-Chloro-2-(1,2-dihydroxyethyl)quinolin-3-yl]ethyl]isoindole-1,3-dione
- IUPAC
- 2-[1-[8-chloro-2-(1,2-dihydroxyethyl)quinolin-3-yl]ethyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL17451261
Database identifiers
- PubChem CID
- 76599375
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 593
Related reactions
2 records
Compound notes
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