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1-[(4-Fluorophenyl)methyl]-5-[2-(phenoxymethyl)azetidin-1-yl]sulfonylindole-2,3-dione

HCID 68935344
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1C(=O)N(Cc2ccc(F)cc2)c2ccc(S(=O)(=O)N3CCC3COc3ccccc3)cc21
InChIKey
QCKJEQIYOITZDI-UHFFFAOYSA-N
Molecular formula
C25H21FN2O5S
Average molar mass
480.5 g/mol

Names & identifiers

Preferred name
1-[(4-Fluorophenyl)methyl]-5-[2-(phenoxymethyl)azetidin-1-yl]sulfonylindole-2,3-dione
IUPAC
1-[(4-fluorophenyl)methyl]-5-[2-(phenoxymethyl)azetidin-1-yl]sulfonylindole-2,3-dione

Names & synonyms

SCHEMBL4156896

Database identifiers

PubChem CID
68935344

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
92.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
34
Formal charge
0
Complexity
863

Related reactions

1 records
New reaction record
HRID 2148804 reaction equation
HRID 2148804As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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