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6-(6-fluoroquinolin-2-yl)-3-(4-methoxyphenoxy)-3,4-dihydro-2H-chromen-4-ol

HCID 19600687
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(OC2COc3ccc(-c4ccc5cc(F)ccc5n4)cc3C2O)cc1
InChIKey
HKVMQGUERWMOIF-UHFFFAOYSA-N
Molecular formula
C25H20FNO4
Average molar mass
417.4 g/mol

Names & identifiers

Preferred name
6-(6-fluoroquinolin-2-yl)-3-(4-methoxyphenoxy)-3,4-dihydro-2H-chromen-4-ol
IUPAC
6-(6-fluoroquinolin-2-yl)-3-(4-methoxyphenoxy)-3,4-dihydro-2H-chromen-4-ol

Names & synonyms

SCHEMBL8465458

Database identifiers

PubChem CID
19600687

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
60.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
31
Formal charge
0
Complexity
586

Related reactions

1 records
New reaction record
HRID 1134838 reaction equation
HRID 1134838As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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