Basic information
- CAS
57179-31-4- Standard SMILES
COC1=C(N)C(=O)c2nc(-c3ccccn3)ccc2C1=O- InChIKey
ZELOUZWBTZRZCJ-UHFFFAOYSA-N- Molecular formula
- C15H11N3O3
- Average molar mass
- 281.27 g/mol
- Monoisotopic mass
- 281.08004122
Names & identifiers
- Preferred name
- Quinoline,2-pyridyl deriv
- IUPAC
- 7-amino-6-methoxy-2-pyridin-2-ylquinoline-5,8-dione
Names & synonyms
NSC28744357179-31-4QUINOLINE,2-PYRIDYL DERIVCHEMBL292182DTXSID50314684NSC-2874435, 7-amino-6-methoxy-2-(2-pyridinyl)-7-Amino-6-methoxy-2-(pyridin-2-yl)quinoline-5,8-dione
Database identifiers
- CAS
57179-31-4- PubChem CID
- 323960
- DTXSID
DTXSID50314684- ChEMBL
CHEMBL292182
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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