Basic information
- CAS
75872-29-6- Standard SMILES
CC(=O)c1nn(-c2ccccc2)c(=Nc2ccccc2)cc1C- InChIKey
KXJVZIXJELLFKF-UHFFFAOYSA-N- Molecular formula
- C19H17N3O
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.13716217
Names & identifiers
- Preferred name
- 1-(4-Methyl-1-phenyl-6-phenyliminopyridazin-3-yl)ethanone
- IUPAC
- 1-(4-methyl-1-phenyl-6-phenyliminopyridazin-3-yl)ethanone
Names & synonyms
MLS00317107875872-29-6NSC350494CHEMBL3187009DTXSID80319783NSC-350494SMR0018749871-[(6E)-4-Methyl-1-phenyl-6-(phenylimino)-1,6-dihydropyridazin-3-yl]ethan-1-one
Database identifiers
- CAS
75872-29-6- PubChem CID
- 336397
- DTXSID
DTXSID80319783- ChEMBL
CHEMBL3187009
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 535
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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