Basic information
- Standard SMILES
O=C(NCc1ccc(Br)cc1)c1cn(N2CCOCC2)c2ccc(CN3CCOCC3)cc2c1=O- InChIKey
QUKVNOCSSDWBNN-UHFFFAOYSA-N- Molecular formula
- C26H29BrN4O4
- Average molar mass
- 541.4 g/mol
Names & identifiers
- Preferred name
- N-[(4-bromophenyl)methyl]-1-morpholino-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxamide
- IUPAC
- N-[(4-bromophenyl)methyl]-1-morpholin-4-yl-6-(morpholin-4-ylmethyl)-4-oxoquinoline-3-carboxamide
Names & synonyms
SCHEMBL6699630QUKVNOCSSDWBNN-UHFFFAOYSA-NN-[(4-bromophenyl)methyl]-1-morpholino-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxamideN-(4-Bromobenzy)-1-(4-morpholinyl)-6-(4-morpholinylmethyl)-4-oxo-1,4-dihydro-3-quinolinecarboxamideN-[(4-Bromophenyl)methyl][1-morpholin-4-yl-6-(morpholin-4-ylmethyl)-4-oxo(3-hydroquinolyl)]carboxamide
Database identifiers
- PubChem CID
- 490489
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 74.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 775
Related reactions
1 records
Compound notes
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