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(4-Chloro-phenyl)-{5-[2-(4,5-dihydro-1H-imidazol-2-yl)pyridin-4-yloxy]-1-methyl-1H-benzoimidazol-2-yl}-amine

HCID 22040586
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cn1c(Nc2ccc(Cl)cc2)nc2cc(Oc3ccnc(C4=NCCN4)c3)ccc21
InChIKey
AXMDSGGERQIART-UHFFFAOYSA-N
Molecular formula
C22H19ClN6O
Average molar mass
418.9 g/mol

Names & identifiers

Preferred name
(4-Chloro-phenyl)-{5-[2-(4,5-dihydro-1H-imidazol-2-yl)pyridin-4-yloxy]-1-methyl-1H-benzoimidazol-2-yl}-amine
IUPAC
N-(4-chlorophenyl)-5-[[2-(4,5-dihydro-1H-imidazol-2-yl)-4-pyridinyl]oxy]-1-methylbenzimidazol-2-amine

Names & synonyms

SCHEMBL2890433AXMDSGGERQIART-UHFFFAOYSA-N(4-Chloro-phenyl)-{5-[2-(4,5-dihydro-1H-imidazol-2-yl)-pyridin-4-yloxy]-1-methyl-1H-benzoimidazol-2-yl}-amine(4-Chloro-phenyl)-{5-[2-(4,5-dihydro-1H-imidazol-2-yl)-pyridin-4-yloxyl]-1-methyl-1H-benzoimidazol-2-yl}-amine(4-Chloro-phenyl)-{5-[2-(4,5-dihydro-1H-imidazol-2-yl)pyridin-4-yloxy]-1-methyl-1H-benzoimidazol-2-yl}-amine

Database identifiers

PubChem CID
22040586

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
76.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Formal charge
0
Complexity
612

Related reactions

5 records
New reaction record
HRID 13451 reaction equation
HRID 13451As productuspto-grants-2010_06
HRID 816027 reaction equation
HRID 816027As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1790663 reaction equation
HRID 1790663As productuspto-grants-2006_07
HRID 1915628 reaction equation
HRID 1915628As productuspto-grants-2013_12
HRID 2070253 reaction equation
HRID 2070253As productuspto-grants-2012_10

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes