2-Methyl-4-phenyl-3H-pyrido[1,2-b]pyridazin-3-one
Basic information
- CAS
60047-71-4- Standard SMILES
Cc1nn2ccccc2c(-c2ccccc2)c1=O- InChIKey
POUISERKQITKHO-UHFFFAOYSA-N- Molecular formula
- C15H12N2O
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.09496301
Names & identifiers
- Preferred name
- 2-Methyl-4-phenyl-3H-pyrido[1,2-b]pyridazin-3-one
- IUPAC
- 2-methyl-4-phenylpyrido[1,2-b]pyridazin-3-one
Names & synonyms
60047-71-42-Methyl-4-phenyl-3H-pyrido[1,2-b]pyridazin-3-oneNSC280608DTXSID40314072NSC-280608
Database identifiers
- CAS
60047-71-4- PubChem CID
- 322548
- DTXSID
DTXSID40314072
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 491
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…