2-Hydroxy-2-((8-hydroxy-7-quinolyl)amino)-4'-nitroacetophenone
Basic information
- CAS
25912-23-6- Standard SMILES
O=C(c1ccc([N+](=O)[O-])cc1)C(O)Nc1ccc2cccnc2c1O- InChIKey
NFQDUEXUKGEWCW-UHFFFAOYSA-N- Molecular formula
- C17H13N3O5
- Average molar mass
- 339.3 g/mol
- Monoisotopic mass
- 339.08552052
Names & identifiers
- Preferred name
- 2-Hydroxy-2-((8-hydroxy-7-quinolyl)amino)-4'-nitroacetophenone
- IUPAC
- 2-hydroxy-2-[(8-hydroxyquinolin-7-yl)amino]-1-(4-nitrophenyl)ethanone
Names & synonyms
25912-23-6BRN 04489232-Hydroxy-2-((8-hydroxy-7-quinolyl)amino)-4'-nitroacetophenoneAcetophenone, 2-hydroxy-2-((8-hydroxy-7-quinolyl)amino)-4'-nitro-DTXSID309488202-Hydroxy-2-[(8-hydroxyquinolin-7-yl)amino]-1-(4-nitrophenyl)ethan-1-one
Database identifiers
- CAS
25912-23-6- PubChem CID
- 213262
- DTXSID
DTXSID30948820
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…