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5-(4-(2-methylindoline-1-carbonyl)pyridin-2-ylamino)-1,3-dihydrospiro[indene-2,3'-pyrrolo-[2,3-b]pyridin]-2'(1'H)-one

HCID 49801375
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1Cc2ccccc2N1C(=O)c1ccnc(Nc2ccc3c(c2)CC2(C3)C(=O)Nc3ncccc32)c1
InChIKey
SOBFTUHZQNFIOJ-UHFFFAOYSA-N
Molecular formula
C30H25N5O2
Average molar mass
487.6 g/mol

Names & identifiers

Preferred name
5-(4-(2-methylindoline-1-carbonyl)pyridin-2-ylamino)-1,3-dihydrospiro[indene-2,3'-pyrrolo-[2,3-b]pyridin]-2'(1'H)-one
IUPAC
5-[[4-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]amino]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one

Names & synonyms

SCHEMBL549381SOBFTUHZQNFIOJ-UHFFFAOYSA-N5-(4-(2-methylindoline-1-carbonyl)pyridin-2-ylamino)-1,3-dihydrospiro[indene-2,3'-pyrrolo-[2,3-b]pyridin]-2'(1'H)-one

Database identifiers

PubChem CID
49801375

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
87.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
37
Formal charge
0
Complexity
897

Related reactions

2 records
New reaction record
HRID 156038 reaction equation
HRID 156038As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1640288 reaction equation
HRID 1640288As productuspto-grants-2012_02

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes