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3-(4-Fluorobenzyl)-N-phenoxy-3H-imidazo[4,5-c]pyridine-6-carboxamide

HCID 10044170
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(NOc1ccccc1)c1cc2ncn(Cc3ccc(F)cc3)c2cn1
InChIKey
KDVSBMKNQNWWGY-UHFFFAOYSA-N
Molecular formula
C20H15FN4O2
Average molar mass
362.4 g/mol
Monoisotopic mass
362.1179039

Names & identifiers

Preferred name
3-(4-Fluorobenzyl)-N-phenoxy-3H-imidazo[4,5-c]pyridine-6-carboxamide
IUPAC
3-[(4-fluorophenyl)methyl]-N-phenoxyimidazo[4,5-c]pyridine-6-carboxamide

Names & synonyms

SCHEMBL2951388KDVSBMKNQNWWGY-UHFFFAOYSA-N3-(4-Fluorobenzyl)-N-phenoxy-3H-imidazo[4,5-c]pyridine-6-carboxamide

Database identifiers

PubChem CID
10044170

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
69 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
27
Formal charge
0
Complexity
494

Related reactions

3 records
New reaction record
HRID 720539 reaction equation
HRID 720539As productuspto-grants-2006_11
HRID 2127233 reaction equation
HRID 2127233As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2221488 reaction equation
HRID 2221488As productuspto-grants-2008_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes