Basic information
- Standard SMILES
COc1cn(-c2ccc(N3CC(F)(F)C(F)(F)C3)cc2F)nc(-c2ccnn2-c2ccccc2)c1=O- InChIKey
RBTZOZXTUHHOST-UHFFFAOYSA-N- Molecular formula
- C24H18F5N5O2
- Average molar mass
- 503.4 g/mol
- Monoisotopic mass
- 503.13806564
Names & identifiers
- Preferred name
- 1-[2-fluoro-4-(3,3,4,4-tetrafluoropyrrolidin-1-yl)phenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one
- IUPAC
- 1-[2-fluoro-4-(3,3,4,4-tetrafluoropyrrolidin-1-yl)phenyl]-5-methoxy-3-(2-phenylpyrazol-3-yl)pyridazin-4-one
Names & synonyms
1-[2-fluoro-4-(3,3,4,4-tetrafluoropyrrolidin-1-yl)phenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-oneSCHEMBL518500SCHEMBL30123152
Database identifiers
- PubChem CID
- 46848740
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 63 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 893
Related reactions
11 records
Compound notes
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