Basic information
- Standard SMILES
Cc1n[nH]c(=O)c(-c2c(F)cccc2F)c1-c1ccccc1- InChIKey
RXBIBMNWXBJWGG-UHFFFAOYSA-N- Molecular formula
- C17H12F2N2O
- Average molar mass
- 298.29 g/mol
- Monoisotopic mass
- 298.09176933
Names & identifiers
- Preferred name
- 4-(2,6-difluorophenyl)-6-methyl-5-phenyl-2H-pyridazin-3-one
- IUPAC
- 5-(2,6-difluorophenyl)-3-methyl-4-phenyl-1H-pyridazin-6-one
Names & synonyms
SCHEMBL10015937RXBIBMNWXBJWGG-UHFFFAOYSA-N4-(2,6-difluorophenyl)-6-methyl-5-phenyl-2H-pyridazin-3-one4-(2,6-difluorophenyl)-6-methyl-5-phenyl-2H-pyridazine-3-one4-(2,6-di fluorophenyl)-6-methyl-5-phenyl-2H-pyridazin-3-one
Database identifiers
- PubChem CID
- 68010028
- Nikkaji
- J3.792.749J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 499
Related reactions
1 records
Compound notes
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