Basic information
- Standard SMILES
CCc1nc2cnc3cc(C=CN4C(=O)c5ccccc5C4=O)ccc3c2n1CC(C)(C)O- InChIKey
KRYALIAMESBVAR-UHFFFAOYSA-N- Molecular formula
- C26H24N4O3
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.18484064
Names & identifiers
- Preferred name
- 2-{2-[2-ethyl-1-(2-hydroxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-7-yl]ethenyl}-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-[2-[2-ethyl-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-7-yl]ethenyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL4527454KRYALIAMESBVAR-UHFFFAOYSA-N2-{2-[2-ethyl-1-(2-hydroxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-7-yl]ethenyl}-1H-isoindole-1,3(2H)-dione2-{2[2-ethyl-1-(2-hydroxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-7-yl]ethenyl}-1H-isoindole-1,3(2H)-dione
Database identifiers
- PubChem CID
- 69079583
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 774
Related reactions
2 records
Compound notes
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