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1-(6-Methyl-2-pyridinyl)-2-(2-phenylethenyl)benzimidazole

HCID 69911907
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cccc(-n2c(C=Cc3ccccc3)nc3ccccc32)n1
InChIKey
ZZHHKUGFCSHUKQ-UHFFFAOYSA-N
Molecular formula
C21H17N3
Average molar mass
311.4 g/mol
Monoisotopic mass
311.14224756

Names & identifiers

Preferred name
1-(6-Methyl-2-pyridinyl)-2-(2-phenylethenyl)benzimidazole
IUPAC
1-(6-methyl-2-pyridinyl)-2-(2-phenylethenyl)benzimidazole

Database identifiers

PubChem CID
69911907

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
30.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
429

Related reactions

1 records
New reaction record
HRID 304337 reaction equation
HRID 304337As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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