4-[6-[[6-Methoxy-4-methyl-8-quinolinyl]amino]hexyl]-1-piperazinepropanol
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Basic information
- Standard SMILES
COc1cc(NCCCCCCN2CCN(CCCO)CC2)c2nccc(C)c2c1- InChIKey
PRDQKGNEQJNJMA-UHFFFAOYSA-N- Molecular formula
- C24H38N4O2
- Average molar mass
- 414.6 g/mol
Names & identifiers
- Preferred name
- 4-[6-[[6-Methoxy-4-methyl-8-quinolinyl]amino]hexyl]-1-piperazinepropanol
- IUPAC
- 3-[4-[6-[(6-methoxy-4-methylquinolin-8-yl)amino]hexyl]piperazin-1-yl]propan-1-ol
Names & synonyms
4-[6-[[6-Methoxy-4-methyl-8-quinolinyl]amino]hexyl]-1-piperazinepropanolCHEMBL58500SCHEMBL107312654-[6-[(6-Methoxy-4-methyl-8-quinolinyl)amino]hexyl]-1-piperazine-propanol3-(4-(6-[(6-Methoxy-4-methyl-8-quinolinyl)amino]hexyl)-1-piperazinyl)-1-propanol #
Database identifiers
- PubChem CID
- 535570
- ChEMBL
CHEMBL58500
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 458
Related reactions
1 records
Compound notes
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