Basic information
- Standard SMILES
COc1c(F)cc(C=O)c(F)c1-c1cc2c(cc1C)C(C)(C)CC(=O)N2C- InChIKey
ADHJHCGBDBRJMB-UHFFFAOYSA-N- Molecular formula
- C21H21F2NO3
- Average molar mass
- 373.4 g/mol
Names & identifiers
- Preferred name
- 2,5-Difluoro-4-methoxy-3-(1,4,4,6-tetramethyl-2-oxo-1,2,3,4-tetrahydro-quinolin-7-yl)-benzaldehyde
- IUPAC
- 2,5-difluoro-4-methoxy-3-(1,4,4,6-tetramethyl-2-oxo-3H-quinolin-7-yl)benzaldehyde
Names & synonyms
SCHEMBL5790499ADHJHCGBDBRJMB-UHFFFAOYSA-N2,5-Difluoro-4-methoxy-3-(1,4,4,6-tetramethyl-2-oxo-1,2,3,4-tetrahydro-quinolin-7-yl)-benzaldehyde
Database identifiers
- PubChem CID
- 21966466
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 584
Related reactions
2 records
Compound notes
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