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3-[5-(2-Diethylamino-ethoxy)-1H-indol-2-ylmethylene]-5-phenyl-1,3-dihydro-indol-2-one

HCID 69586980
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCN(CC)CCOc1ccc2[nH]c(C=C3C(=O)Nc4ccc(-c5ccccc5)cc43)cc2c1
InChIKey
ASPKDPFPPWLGHH-UHFFFAOYSA-N
Molecular formula
C29H29N3O2
Average molar mass
451.6 g/mol

Names & identifiers

Preferred name
3-[5-(2-Diethylamino-ethoxy)-1H-indol-2-ylmethylene]-5-phenyl-1,3-dihydro-indol-2-one
IUPAC
3-[[5-[2-(diethylamino)ethoxy]-1H-indol-2-yl]methylidene]-5-phenyl-1H-indol-2-one

Names & synonyms

SCHEMBL5842106ASPKDPFPPWLGHH-UHFFFAOYSA-N3-[5-(2-Diethylamino-ethoxy)-1H-indol-2-ylmethylene]-5-phenyl-1,3-dihydro-indol-2-one

Database identifiers

PubChem CID
69586980

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
57.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
34
Formal charge
0
Complexity
714

Related reactions

3 records
New reaction record
HRID 49078 reaction equation
HRID 49078As productuspto-grants-2004_03
HRID 317475 reaction equation
HRID 317475As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1790929 reaction equation
HRID 1790929As productuspto-grants-2006_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes