Basic information
- Standard SMILES
Cc1ccc2c(N3CCN(CCc4cccc(NC(=O)C(C)C)c4)CC3)cccc2n1- InChIKey
SYWSPGNYZDCPLZ-UHFFFAOYSA-N- Molecular formula
- C26H32N4O
- Average molar mass
- 416.6 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-N-(3-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)propanamide
- IUPAC
- 2-methyl-N-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]propanamide
Names & synonyms
SCHEMBL2883685CHEMBL1632208SYWSPGNYZDCPLZ-UHFFFAOYSA-N2-Methyl-N-(3-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl) propanamide2-Methyl-N-(3-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)propanamide
Database identifiers
- PubChem CID
- 49852002
- ChEMBL
CHEMBL1632208
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 574
Related reactions
5 records
Linked notes
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