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5-Bromo-3-[5-(2-morpholin-4-yl-ethoxy)-1H-indol-2-ylmethylene]-1,3-dihydro-indol-2-one

HCID 69586546
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1Nc2ccc(Br)cc2C1=Cc1cc2cc(OCCN3CCOCC3)ccc2[nH]1
InChIKey
KCYFTDKLDHDJFZ-UHFFFAOYSA-N
Molecular formula
C23H22BrN3O3
Average molar mass
468.3 g/mol

Names & identifiers

Preferred name
5-Bromo-3-[5-(2-morpholin-4-yl-ethoxy)-1H-indol-2-ylmethylene]-1,3-dihydro-indol-2-one
IUPAC
5-bromo-3-[[5-(2-morpholin-4-ylethoxy)-1H-indol-2-yl]methylidene]-1H-indol-2-one

Names & synonyms

SCHEMBL5840667KCYFTDKLDHDJFZ-UHFFFAOYSA-N5-Bromo-3-[5-(2-morpholin-4-yl-ethoxy)-1H-indol-2-ylmethylene]-1,3-dihydro-indol-2-one

Database identifiers

PubChem CID
69586546

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
66.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
30
Formal charge
0
Complexity
654

Related reactions

3 records
New reaction record
HRID 49067 reaction equation
HRID 49067As productuspto-grants-2004_03
HRID 1207984 reaction equation
HRID 1207984As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1790918 reaction equation
HRID 1790918As productuspto-grants-2006_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes