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5-chloro-3-(2-methoxyphenyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-dihydro-2H-indol-2-one

HCID 67429040
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COc1ccccc1C1(CC(=O)N2CCN(c3ccccn3)CC2)C(=O)Nc2ccc(Cl)cc21
InChIKey
IZICIDYBFPUUIY-UHFFFAOYSA-N
Molecular formula
C26H25ClN4O3
Average molar mass
477 g/mol

Names & identifiers

Preferred name
5-chloro-3-(2-methoxyphenyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-dihydro-2H-indol-2-one
IUPAC
5-chloro-3-(2-methoxyphenyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1H-indol-2-one

Names & synonyms

SCHEMBL2496303IZICIDYBFPUUIY-UHFFFAOYSA-N5-chloro-3-(2-methoxyphenyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-dihydro-2H-i ndol-2-one5-chloro-3-(2-methoxyphenyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-dihydro-2H-indol-2-one

Database identifiers

PubChem CID
67429040

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
74.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
34
Formal charge
0
Complexity
746

Related reactions

3 records
New reaction record
HRID 1208016 reaction equation
HRID 1208016As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1662632 reaction equation
HRID 1662632As productuspto-grants-2011_10
HRID 1662633 reaction equation
HRID 1662633As reactantuspto-grants-2011_10

Compound notes

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