1-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1h-isoindol-5-ylmethyl]-urea

HCID 44539019
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Basic information

Standard SMILES
O=C1CCC(N2Cc3cc(CNC(=O)Nc4ccc5c(c4)OCCO5)ccc3C2=O)C(=O)N1
InChIKey
WVESXEJQDGHYPS-UHFFFAOYSA-N
Molecular formula
C23H22N4O6
Average molar mass
450.4 g/mol

Names & identifiers

Preferred name
1-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1h-isoindol-5-ylmethyl]-urea
IUPAC
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]methyl]urea

Names & synonyms

SCHEMBL1413631WVESXEJQDGHYPS-UHFFFAOYSA-N1-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-3-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1h-isoindol-5-ylmethyl]-urea

Database identifiers

PubChem CID
44539019

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
126 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
33

Related reactions

2 records
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Compound notes

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