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Compound
(2-pyridyl)-2-styryl-1H-benzimidazole
HCID
53919081
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Basic information
Names & identifiers
Properties
Related reactions
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Basic information
Standard SMILES
C(=Cc1nc2ccccc2n1-c1ccccn1)c1ccccc1
InChIKey
IJDTXOQVVWVBSO-UHFFFAOYSA-N
Molecular formula
C20H15N3
Average molar mass
297.4 g/mol
Names & identifiers
Preferred name
(2-pyridyl)-2-styryl-1H-benzimidazole
IUPAC
2-(2-phenylethenyl)-1-pyridin-2-ylbenzimidazole
Names & synonyms
SCHEMBL6835941
IJDTXOQVVWVBSO-UHFFFAOYSA-N
(2-pyridyl)-2-styryl-1H-benzimidazole
Database identifiers
PubChem CID
53919081
Properties
Computed structural properties
XLogP
4.7
Topological polar surface area
30.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
402
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Related reactions
13 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
168899
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
179292
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
292596
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
304337
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
310682
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
314387
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
956802
As reactant
Validation data from https://doi.org/10.1039/C8SC04228D
HRID
1216635
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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