Basic information
- CAS
332173-88-3- Standard SMILES
CC(C)C(=O)NC(c1cccc([N+](=O)[O-])c1)c1ccc2cccnc2c1O- InChIKey
VKNRECYYHACCGX-UHFFFAOYSA-N- Molecular formula
- C20H19N3O4
- Average molar mass
- 365.4 g/mol
- Monoisotopic mass
- 365.1375561
Names & identifiers
- Preferred name
- N-[(8-Hydroxy-7-quinolinyl)(3-nitrophenyl)methyl]-2-methylpropanamide
- IUPAC
- N-[(8-hydroxyquinolin-7-yl)-(3-nitrophenyl)methyl]-2-methylpropanamide
Names & synonyms
332173-88-3N-[(8-Hydroxy-7-quinolinyl)(3-nitrophenyl)methyl]-2-methylpropanamideN-((8-Hydroxy-7-quinolinyl)(3-nitrophenyl)methyl)-2-methylpropanamideRefChem:359694N-[(8-hydroxyquinolin-7-yl)(3-nitrophenyl)methyl]-2-methylpropanamideN-[(8-Hydroxy-quinolin-7-yl)-(3-nitro-phenyl)-methyl]-isobutyramideOprea1_108040Oprea1_327040MLS001204098CHEMBL1410758DTXSID701157203HMS2844L08
Show more names
AKOS000538812AKOS021600880SMR000516571EU-0040546ST50008349SR-01000453984SR-01000453984-1
Database identifiers
- CAS
332173-88-3- PubChem CID
- 3129253
- DTXSID
DTXSID701157203- ChEMBL
CHEMBL1410758
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 536
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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