4-(2,4-Dimethoxy-phenylamino)-2-[(3S)-3-methyl-2,6-dioxo-piperidin-3-YL]-isoindole-1,3-dione

HCID 58827353
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Basic information

Standard SMILES
COc1ccc(Nc2cccc3c2C(=O)N([C@@]2(C)CCC(=O)NC2=O)C3=O)c(OC)c1
InChIKey
XNPDMZOMFKOCLF-QFIPXVFZSA-N
Molecular formula
C22H21N3O6
Average molar mass
423.4 g/mol
Monoisotopic mass
423.1430354

Names & identifiers

Preferred name
4-(2,4-Dimethoxy-phenylamino)-2-[(3S)-3-methyl-2,6-dioxo-piperidin-3-YL]-isoindole-1,3-dione
IUPAC
4-(2,4-dimethoxyanilino)-2-[(3S)-3-methyl-2,6-dioxopiperidin-3-yl]isoindole-1,3-dione

Names & synonyms

SCHEMBL1962345XNPDMZOMFKOCLF-QFIPXVFZSA-N4-(2,4-DIMETHOXY-PHENYLAMINO)-2-[(3S)-3-METHYL-2,6-DIOXO-PIPERIDIN-3-YL]-ISOINDOLE-1,3-DIONE

Database identifiers

PubChem CID
58827353

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
31

Related reactions

1 records
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Compound notes

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