Basic information
- Standard SMILES
Clc1ccc(-c2nnc(Br)cc2Br)cc1.Oc1cc(Br)nnc1-c1ccc(Cl)cc1- InChIKey
ULXLAPAJDGXPAG-UHFFFAOYSA-N- Molecular formula
- C20H11Br3Cl2N4O
- Average molar mass
- 633.9 g/mol
- Monoisotopic mass
- 629.786
Names & identifiers
- Preferred name
- 3-(4'-Chlorophenyl)-4-hydroxy-6-bromopyridazine 3-(4'-Chlorophenyl)-4,6-dibromopyridazine
- IUPAC
- 6-bromo-3-(4-chlorophenyl)-1H-pyridazin-4-one;4,6-dibromo-3-(4-chlorophenyl)pyridazine
Names & synonyms
ULXLAPAJDGXPAG-UHFFFAOYSA-N3-(4'-Chlorophenyl)-4-hydroxy-6-bromopyridazine 3-(4'-Chlorophenyl)-4,6-dibromopyridazine
Database identifiers
- PubChem CID
- 86748234
Properties
Computed structural properties
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 542
Related reactions
1 records
Compound notes
Loading…