2-(3-(3-(2-Hydroxy-2-phenylethoxy)phenyl)propyl)isoindoline-1,3-dione
Basic information
- Standard SMILES
O=C1c2ccccc2C(=O)N1CCCc1cccc(OCC(O)c2ccccc2)c1- InChIKey
KSINAVQUPGQZFS-UHFFFAOYSA-N- Molecular formula
- C25H23NO4
- Average molar mass
- 401.5 g/mol
Names & identifiers
- Preferred name
- 2-(3-(3-(2-Hydroxy-2-phenylethoxy)phenyl)propyl)isoindoline-1,3-dione
- IUPAC
- 2-[3-[3-(2-hydroxy-2-phenylethoxy)phenyl]propyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL2209896KSINAVQUPGQZFS-UHFFFAOYSA-N2-(3-(3-(2-hydroxy-2-phenylethoxy)phenyl)propyl)isoindoline-1,3-dione
Database identifiers
- PubChem CID
- 67317841
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 564
Related reactions
6 records
Compound notes
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