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N-[6-(1H-Indol-4-yl)-1H-indazol-4-yl]-4-methyl-2-morpholinecarboxamide

HCID 44540403
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN1CCOC(C(=O)Nc2cc(-c3cccc4[nH]ccc34)cc3[nH]ncc23)C1
InChIKey
RGMGHVMUSBVCJW-UHFFFAOYSA-N
Molecular formula
C21H21N5O2
Average molar mass
375.4 g/mol

Names & identifiers

Preferred name
N-[6-(1H-Indol-4-yl)-1H-indazol-4-yl]-4-methyl-2-morpholinecarboxamide
IUPAC
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-4-methylmorpholine-2-carboxamide

Names & synonyms

1198409-19-6N-[6-(1H-Indol-4-yl)-1H-indazol-4-yl]-4-methyl-2-morpholinecarboxamideSCHEMBL2166458CHEMBL2216838RGMGHVMUSBVCJW-UHFFFAOYSA-NDA-47370

Database identifiers

PubChem CID
44540403
ChEMBL
CHEMBL2216838

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
86 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
28
Formal charge
0
Complexity
575

Related reactions

2 records
New reaction record
HRID 42256 reaction equation
HRID 42256As productuspto-grants-2013_09
HRID 285024 reaction equation
HRID 285024As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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