1-(2-bromo-ethyl)-6-(4-ethoxy-3-trifluoromethyl-phenyl)-1H-imidazo[4,5-c]pyridine-4-carbonitrile

HCID 58938121
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Basic information

Standard SMILES
CCOc1ccc(-c2cc3c(ncn3CCBr)c(C#N)n2)cc1C(F)(F)F
InChIKey
PGRJNJGWCARQFL-UHFFFAOYSA-N
Molecular formula
C18H14BrF3N4O
Average molar mass
439.2 g/mol

Names & identifiers

Preferred name
1-(2-bromo-ethyl)-6-(4-ethoxy-3-trifluoromethyl-phenyl)-1H-imidazo[4,5-c]pyridine-4-carbonitrile
IUPAC
1-(2-bromoethyl)-6-[4-ethoxy-3-(trifluoromethyl)phenyl]imidazo[4,5-c]pyridine-4-carbonitrile

Names & synonyms

1-(2-bromo-ethyl)-6-(4-ethoxy-3-trifluoromethyl-phenyl)-1H-imidazo[4,5-c]pyridine-4-carbonitrileSCHEMBL3106795

Database identifiers

PubChem CID
58938121

Properties

Computed structural properties

XLogP
4
Topological polar surface area
63.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
27

Related reactions

4 records
New reaction record

Compound notes

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