Basic information
- Standard SMILES
CCC(=O)c1cc(C(C)(C)C)ccc1Oc1ccnc2cc(OC)c(OC)cc12- InChIKey
MIAZAUGXUFIVLO-UHFFFAOYSA-N- Molecular formula
- C24H27NO4
- Average molar mass
- 393.5 g/mol
Names & identifiers
- Preferred name
- 1-{5-(Tert-butyl)-2-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}-1-propanone
- IUPAC
- 1-[5-tert-butyl-2-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]propan-1-one
Names & synonyms
SCHEMBL3895222MIAZAUGXUFIVLO-UHFFFAOYSA-N1-{5-(Tert-butyl)-2-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}-1-propanone
Database identifiers
- PubChem CID
- 57756459
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 545
Related reactions
2 records
Compound notes
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