Basic information
- Standard SMILES
CC(C)COc1c(Br)cnn(-c2cccc(Cl)c2)c1=O- InChIKey
CZXWVAQMMOEUBH-UHFFFAOYSA-N- Molecular formula
- C14H14BrClN2O2
- Average molar mass
- 357.63 g/mol
Names & identifiers
- Preferred name
- 2-(3-Chlorophenyl)-4-(2-methylpropoxy)-5-bromo-3(2H)-pyridazinone
- IUPAC
- 5-bromo-2-(3-chlorophenyl)-4-(2-methylpropoxy)pyridazin-3-one
Names & synonyms
SCHEMBL4189818CZXWVAQMMOEUBH-UHFFFAOYSA-N2-(3-Chlorophenyl)-4-(2-methylpropoxy)-5-bromo-3(2H)-pyridazinone2-(3-Chloro-phenyl)-4-(2-methylpropoxy)-5-bromo-3(2H)-pyridazinone
Database identifiers
- PubChem CID
- 21933864
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 437
Related reactions
8 records
Compound notes
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