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N-[[2-[[4-(3-benzyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]-1-phenylcyclopropyl]methyl]-N-methylbenzenesulfonamide

HCID 9893941
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CN(CC1(c2ccccc2)CC1CN1CCC(c2nc(Cc3ccccc3)no2)CC1)S(=O)(=O)c1ccccc1
InChIKey
FLZXYKULCFFPTK-UHFFFAOYSA-N
Molecular formula
C32H36N4O3S
Average molar mass
556.7 g/mol

Names & identifiers

Preferred name
N-[[2-[[4-(3-benzyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]-1-phenylcyclopropyl]methyl]-N-methylbenzenesulfonamide
IUPAC
N-[[2-[[4-(3-benzyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]-1-phenylcyclopropyl]methyl]-N-methylbenzenesulfonamide

Names & synonyms

SCHEMBL13719830

Database identifiers

PubChem CID
9893941

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
87.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
40
Formal charge
0
Complexity
902

Related reactions

1 records
New reaction record
HRID 201758 reaction equation
HRID 201758As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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