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1-(2,4-Difluorophenyl)-8-fluoro-3,4-dimethylimidazo[1,5-a]quinoxaline

HCID 42629232
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc(-c2ccc(F)cc2F)n2c1c(C)nc1ccc(F)cc12
InChIKey
HWABLBLJIZFXJB-UHFFFAOYSA-N
Molecular formula
C18H12F3N3
Average molar mass
327.3 g/mol

Names & identifiers

Preferred name
1-(2,4-Difluorophenyl)-8-fluoro-3,4-dimethylimidazo[1,5-a]quinoxaline
IUPAC
1-(2,4-difluorophenyl)-8-fluoro-3,4-dimethylimidazo[1,5-a]quinoxaline

Names & synonyms

SCHEMBL972275HWABLBLJIZFXJB-UHFFFAOYSA-N1-(2,4-difluorophenyl)-8-fluoro-3,4-dimethylimidazo[1,5-a]quinoxaline

Database identifiers

PubChem CID
42629232

Properties

Computed structural properties

XLogP
5
Topological polar surface area
30.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
24
Formal charge
0
Complexity
465

Related reactions

2 records
New reaction record
HRID 195499 reaction equation
HRID 195499As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 254298 reaction equation
HRID 254298As productuspto-grants-2011_01

Compound notes

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