Basic information
- Standard SMILES
CCOc1cc2ncc(C#N)c(Nc3ccc4c(C)cc(=O)oc4c3)c2cc1OCC- InChIKey
SKWITGADMHWLHT-UHFFFAOYSA-N- Molecular formula
- C24H21N3O4
- Average molar mass
- 415.4 g/mol
- Monoisotopic mass
- 415.15320616
Names & identifiers
- Preferred name
- 6,7-Diethoxy-4-(4-methyl-2-oxo-2H-chromen-7-ylamino)-quinoline-3-carbonitrile
- IUPAC
- 6,7-diethoxy-4-[(4-methyl-2-oxochromen-7-yl)amino]quinoline-3-carbonitrile
Names & synonyms
SCHEMBL4445446SKWITGADMHWLHT-UHFFFAOYSA-N6,7-Diethoxy-4-(4-methyl-2-oxo-2H-chromen-7-ylamino)-quinoline-3-carbonitrile
Database identifiers
- PubChem CID
- 9866525
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 732
Related reactions
2 records
Compound notes
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