2-[3-[(6-Methoxyquinolin-8-yl)amino]propyl]isoindole-1,3-dione
Basic information
- CAS
7399-04-4- Standard SMILES
COc1cc(NCCCN2C(=O)c3ccccc3C2=O)c2ncccc2c1- InChIKey
HMZXJEHXIUYKCU-UHFFFAOYSA-N- Molecular formula
- C21H19N3O3
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.14264148
Names & identifiers
- Preferred name
- 2-[3-[(6-Methoxyquinolin-8-yl)amino]propyl]isoindole-1,3-dione
- IUPAC
- 2-[3-[(6-methoxyquinolin-8-yl)amino]propyl]isoindole-1,3-dione
Names & synonyms
7399-04-42-[3-[(6-methoxyquinolin-8-yl)amino]propyl]isoindole-1,3-dioneNSC55139NCIOpen2_007485DTXSID50328807NSC-55139DS-002962N-[3-(6-Methoxy-8-quinolylamino)propyl]phthalimide2-[3-[(6-methoxy-8-quinolyl)amino]propyl]isoindoline-1,3-dione1H-isoindole-1,3(2h)-dione,2-[3-[(6-methoxy-8-quinolinyl)amino]propyl]-2-{3-[(6-Methoxyquinolin-8-yl)amino]propyl}-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
7399-04-4- PubChem CID
- 414097
- DTXSID
DTXSID50328807
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 531
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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