1-(3,4-Dimethoxy-phenyl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-urea

HCID 44538829
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Basic information

Standard SMILES
COc1ccc(NC(=O)NCc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)cc1OC
InChIKey
DIYSGEKYKKHRCG-UHFFFAOYSA-N
Molecular formula
C23H24N4O6
Average molar mass
452.5 g/mol
Monoisotopic mass
452.1695845

Names & identifiers

Preferred name
1-(3,4-Dimethoxy-phenyl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-urea
IUPAC
1-(3,4-dimethoxyphenyl)-3-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]methyl]urea

Names & synonyms

SCHEMBL1413546DIYSGEKYKKHRCG-UHFFFAOYSA-N1-(3,4-Dimethoxy-phenyl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-urea

Database identifiers

PubChem CID
44538829

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
126 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
33

Related reactions

2 records
New reaction record

Compound notes

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