6-(Benzhydrylidene-amino)-1-ethyl-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester
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Basic information
- Standard SMILES
CCOC(=O)c1cn(CC)c2ccc(N=C(c3ccccc3)c3ccccc3)cc2c1=O- InChIKey
FNCAJEQSTZHOCF-UHFFFAOYSA-N- Molecular formula
- C27H24N2O3
- Average molar mass
- 424.5 g/mol
Names & identifiers
- Preferred name
- 6-(Benzhydrylidene-amino)-1-ethyl-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester
- IUPAC
- ethyl 6-(benzhydrylideneamino)-1-ethyl-4-oxoquinoline-3-carboxylate
Names & synonyms
SCHEMBL3812472FNCAJEQSTZHOCF-UHFFFAOYSA-N6-(Benzhydrylidene-amino)-1-ethyl-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 57720070
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 711
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Related reactions
2 records
Compound notes
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