Basic information
- CAS
7547-92-4- Standard SMILES
O=c1c2ccccc2cc2ccccn12- InChIKey
ZVBAUAXBXPSCCK-UHFFFAOYSA-N- Molecular formula
- C13H9NO
- Average molar mass
- 195.22 g/mol
- Monoisotopic mass
- 195.06841391
Names & identifiers
- Preferred name
- 6h-Pyrido[1,2-b]isoquinolin-6-one
- IUPAC
- benzo[b]quinolizin-6-one
Names & synonyms
6h-pyrido[1,2-b]isoquinolin-6-one7547-92-4NSC153602SCHEMBL16175965DTXSID70996926AKOS004907521NSC-153602
Database identifiers
- CAS
7547-92-4- PubChem CID
- 290341
- DTXSID
DTXSID70996926- Nikkaji
- J3.631.422B
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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