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N-(2-{2-[(4-Hydroxy-5-isopropyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl)-phenyl-methyl]-1H-indol-3-yl}-ethyl)-benzamide

HCID 57933477
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)C1NC(=O)C(C(c2ccccc2)c2[nH]c3ccccc3c2CCNC(=O)c2ccccc2)=C1O
InChIKey
NSLXXFMAGPUBQZ-UHFFFAOYSA-N
Molecular formula
C31H31N3O3
Average molar mass
493.6 g/mol

Names & identifiers

Preferred name
N-(2-{2-[(4-Hydroxy-5-isopropyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl)-phenyl-methyl]-1H-indol-3-yl}-ethyl)-benzamide
IUPAC
N-[2-[2-[(3-hydroxy-5-oxo-2-propan-2-yl-1,2-dihydropyrrol-4-yl)-phenylmethyl]-1H-indol-3-yl]ethyl]benzamide

Names & synonyms

SCHEMBL4492602NSLXXFMAGPUBQZ-UHFFFAOYSA-NN-(2-{2-[(4-Hydroxy-5-isopropyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl)-phenyl-methyl]-1H-indol-3-yl}-ethyl)-benzamide

Database identifiers

PubChem CID
57933477

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
94.2 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
37
Formal charge
0
Complexity
843

Related reactions

1 records
New reaction record
HRID 1432446 reaction equation
HRID 1432446As productuspto-grants-2009_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes