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Compound
6-(benzimidazol-1-yl)-N-[1-(4-methoxyphenyl)ethyl]pyrazin-2-amine
HCID
70917006
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Basic information
Standard SMILES
COc1ccc(C(C)Nc2cncc(-n3cnc4ccccc43)n2)cc1
InChIKey
HCONYHAGNYACEY-UHFFFAOYSA-N
Molecular formula
C20H19N5O
Average molar mass
345.4 g/mol
Names & identifiers
Preferred name
6-(benzimidazol-1-yl)-N-[1-(4-methoxyphenyl)ethyl]pyrazin-2-amine
IUPAC
6-(benzimidazol-1-yl)-N-[1-(4-methoxyphenyl)ethyl]pyrazin-2-amine
Names & synonyms
SCHEMBL13478837
Database identifiers
PubChem CID
70917006
Properties
Computed structural properties
XLogP
3.5
Topological polar surface area
64.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
442
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Related reactions
1 records
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As solvent
HRID
86030
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Compound notes
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