Basic information
- Standard SMILES
CCC(CC)(CC(=O)Nc1cccc(OCc2ccc3ccc(F)cc3n2)c1)C(=O)OC- InChIKey
HIANJEHCRPMMRY-UHFFFAOYSA-N- Molecular formula
- C25H27FN2O4
- Average molar mass
- 438.5 g/mol
Names & identifiers
- Preferred name
- 4-[3-(7-Fluoro-2-quinolinylmethoxy)phenylamino]-2,2-diethyl-4-oxobutanoic acid methyl ester
- IUPAC
- methyl 2,2-diethyl-4-[3-[(7-fluoroquinolin-2-yl)methoxy]anilino]-4-oxobutanoate
Names & synonyms
SCHEMBL9015194HIANJEHCRPMMRY-UHFFFAOYSA-N4-[3-(7-fluoro-2-quinolinylmethoxy)phenylamino]-2,2-diethyl-4-oxobutanoic acid methyl ester
Database identifiers
- PubChem CID
- 53878377
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 627
Related reactions
1 records
Compound notes
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