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1-(benzothiazol-6-yl)-3-(1-((2-(trimethylsilyl)-ethoxy)methyl)-1H-pyrrolo [2,3-b]pyridin-5-yl)imidazolidin-2-one

HCID 59636183
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C[Si](C)(C)CCOCn1ccc2cc(N3CCN(c4ccc5ncsc5c4)C3=O)cnc21
InChIKey
AQTIPXGOQGJGFC-UHFFFAOYSA-N
Molecular formula
C23H27N5O2SSi
Average molar mass
465.6 g/mol

Names & identifiers

Preferred name
1-(benzothiazol-6-yl)-3-(1-((2-(trimethylsilyl)-ethoxy)methyl)-1H-pyrrolo [2,3-b]pyridin-5-yl)imidazolidin-2-one
IUPAC
1-(1,3-benzothiazol-6-yl)-3-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]imidazolidin-2-one

Names & synonyms

SCHEMBL3789076AQTIPXGOQGJGFC-UHFFFAOYSA-N1-(benzothiazol-6-yl)-3-(1-((2-(trimethylsilyl)-ethoxy)methyl)-1H-pyrrolo [2,3-b]pyridin-5-yl)imidazolidin-2-one1-(benzothiazol-6-yl)-3-(1-((2-(trimethylsilyl)-ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridin-5-yl)imidazolidin-2-one

Database identifiers

PubChem CID
59636183

Properties

Computed structural properties

Topological polar surface area
91.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Formal charge
0
Complexity
679

Related reactions

6 records
New reaction record
HRID 80252 reaction equation
HRID 80252As productuspto-grants-2014_09
HRID 80253 reaction equation
HRID 80253As reactantuspto-grants-2014_09
HRID 114222 reaction equation
HRID 114222As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 2315972 reaction equation
HRID 2315972As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2383939 reaction equation
HRID 2383939As productuspto-grants-2012_09
HRID 2383940 reaction equation
HRID 2383940As reactantuspto-grants-2012_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes