3-[2-(2-oxo-1,2-dihydroindol-3-ylidenemethyl)-4,5,6,7-tetrahydro-1H-indol-3-yl]-propionic acid

HCID 54123744

Basic information

Standard SMILES
O=C(O)CCc1c(C=C2C(=O)Nc3ccccc32)[nH]c2c1CCCC2
InChIKey
NPNOMACTPXEJJY-UHFFFAOYSA-N
Molecular formula
C20H20N2O3
Average molar mass
336.4 g/mol

Names & identifiers

Preferred name
3-[2-(2-oxo-1,2-dihydroindol-3-ylidenemethyl)-4,5,6,7-tetrahydro-1H-indol-3-yl]-propionic acid
IUPAC
3-[2-[(2-oxo-1H-indol-3-ylidene)methyl]-4,5,6,7-tetrahydro-1H-indol-3-yl]propanoic acid

Names & synonyms

SCHEMBL6297814NPNOMACTPXEJJY-UHFFFAOYSA-N3-[2-(2-Oxo-1,2-dihydro-indol-3-ylidenemethyl)-4,5,6,7-tetrahydro-1H-indol-3-yl]-propionic acid3-[2-(2-oxo-1,2-dihydroindol-3-ylidenemethyl)-4,5,6,7-tetrahydro-1H-indol-3-yl]-propionic acid

Database identifiers

PubChem CID
54123744

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
82.2 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
25

Related reactions

15 records

Compound notes

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