Basic information
- Standard SMILES
O=C1c2ccccc2C(=O)N1CCCN1CCN(c2ccccc2)CC1- InChIKey
IXYMLHRXRRYXSJ-UHFFFAOYSA-N- Molecular formula
- C21H23N3O2
- Average molar mass
- 349.4 g/mol
Names & identifiers
- Preferred name
- 2-[3-(4-Phenyl-piperazin-1-yl)-propyl]-isoindole-1,3-dione
- IUPAC
- 2-[3-(4-phenylpiperazin-1-yl)propyl]isoindole-1,3-dione
Names & synonyms
CHEMBL273102-[3-(4-Phenyl-piperazin-1-yl)-propyl]-isoindole-1,3-dioneSCHEMBL7986148BDBM50018464N-[3-(4-phenyl-1-piperazinyl)propyl]phthalimide2-[3-(4-phenylpiperazin-1-yl)propyl]isoindoline-1,3-dione
Database identifiers
- PubChem CID
- 6424809
- ChEMBL
CHEMBL27310
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 485
Related reactions
6 records
Linked notes
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