Basic information
- Standard SMILES
Cc1ccc(NC(=O)NCc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)cc1- InChIKey
PPUPXJFDYJVVDE-UHFFFAOYSA-N- Molecular formula
- C22H22N4O4
- Average molar mass
- 406.4 g/mol
Names & identifiers
- Preferred name
- 1-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-3-p-tolyl-urea
- IUPAC
- 1-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]methyl]-3-(4-methylphenyl)urea
Names & synonyms
SCHEMBL1413606PPUPXJFDYJVVDE-UHFFFAOYSA-N1-[2-(2,6-dioxo-piperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-3-p-tolyl-urea
Database identifiers
- PubChem CID
- 44539326
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 703
Related reactions
2 records
Compound notes
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