Basic information
- Standard SMILES
O=C1CCC(N2C(=O)c3cccc(NCc4ccco4)c3C2=O)C(=O)N1- InChIKey
YPKGJVAMXZZNGJ-UHFFFAOYSA-N- Molecular formula
- C18H15N3O5
- Average molar mass
- 353.3 g/mol
Names & identifiers
- Preferred name
- 2-(2,6-Dioxo(3-piperidyl))-4-[(2-furylmethyl)amino]isoindoline-1,3-dione
- IUPAC
- 2-(2,6-dioxopiperidin-3-yl)-4-(furan-2-ylmethylamino)isoindole-1,3-dione
Names & synonyms
SCHEMBL2383906CHEMBL5786105SCHEMBL29453443YPKGJVAMXZZNGJ-UHFFFAOYSA-NBDBM511664US11059801, Compound D-312-(2,6-Dioxo(3-piperidyl))-4-[(2-furylmethyl)amino]isoindoline-1,3-dione
Database identifiers
- PubChem CID
- 9924676
- ChEMBL
CHEMBL5786105
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 636
Related reactions
3 records
Linked notes
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