N-(4'-Methylsulfanyl-1,1'-biphenyl-4-yl)-1-azabicyclo[2.2.2]octane-3-carboxamide Hydrochloride

HCID 21883465
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Basic information

Standard SMILES
CSc1ccc(-c2ccc(NC(=O)C3CN4CCC3CC4)cc2)cc1.Cl
InChIKey
KJQWZPVCRRLJHT-UHFFFAOYSA-N
Molecular formula
C21H25ClN2OS
Average molar mass
389 g/mol

Names & identifiers

Preferred name
N-(4'-Methylsulfanyl-1,1'-biphenyl-4-yl)-1-azabicyclo[2.2.2]octane-3-carboxamide Hydrochloride
IUPAC
N-[4-(4-methylsulfanylphenyl)phenyl]-1-azabicyclo[2.2.2]octane-3-carboxamide;hydrochloride

Names & synonyms

SCHEMBL5171211KJQWZPVCRRLJHT-UHFFFAOYSA-NN-(4'-Methylsulfanyl-1,1'-biphenyl-4-yl)-1-azabicyclo[2.2.2]octane-3-carboxamide Hydrochloride

Database identifiers

PubChem CID
21883465

Properties

Computed structural properties

Topological polar surface area
57.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
26

Related reactions

1 records
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Compound notes

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