3-Benzyl-4-{3-[(2,6-Dimethylbenzyl)Oxy]Phenyl}-8-(Trifluoromethyl)Quinoline
Basic information
- Standard SMILES
Cc1cccc(C)c1COc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1- InChIKey
SCGSHPSDXXYOQL-UHFFFAOYSA-N- Molecular formula
- C32H26F3NO
- Average molar mass
- 497.5 g/mol
- Monoisotopic mass
- 497.19664894
Names & identifiers
- Preferred name
- 3-Benzyl-4-{3-[(2,6-Dimethylbenzyl)Oxy]Phenyl}-8-(Trifluoromethyl)Quinoline
- IUPAC
- 3-benzyl-4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-8-(trifluoromethyl)quinoline
Names & synonyms
3-Benzyl-4-{3-[(2,6-Dimethylbenzyl)Oxy]Phenyl}-8-(Trifluoromethyl)QuinolineSCHEMBL1124833
Database identifiers
- PubChem CID
- 66913629
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 697
Related reactions
2 records
Compound notes
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