Ethyl 5-fluoro-4-oxo-1-[4-(4-vinyl-1H-pyrazol-1-yl)benzyl]-1,4-dihydroquinoline-3-carboxylate

HCID 44623933
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Basic information

Standard SMILES
C=Cc1cnn(-c2ccc(Cn3cc(C(=O)OCC)c(=O)c4c(F)cccc43)cc2)c1
InChIKey
DFPGYWMGYZEEDF-UHFFFAOYSA-N
Molecular formula
C24H20FN3O3
Average molar mass
417.4 g/mol

Names & identifiers

Preferred name
Ethyl 5-fluoro-4-oxo-1-[4-(4-vinyl-1H-pyrazol-1-yl)benzyl]-1,4-dihydroquinoline-3-carboxylate
IUPAC
ethyl 1-[[4-(4-ethenylpyrazol-1-yl)phenyl]methyl]-5-fluoro-4-oxoquinoline-3-carboxylate

Names & synonyms

SCHEMBL1931415DFPGYWMGYZEEDF-UHFFFAOYSA-NEthyl 5-fluoro-4-oxo-1-[4-(4-vinyl-1H-pyrazol-1-yl)benzyl]-1,4-dihydroquinoline-3-carboxylate

Database identifiers

PubChem CID
44623933

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
64.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
31

Related reactions

2 records
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Compound notes

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