Basic information
- Standard SMILES
Fc1ccccc1C#Cc1cc(OCc2ccccc2)c(OCc2ccccc2)nn1- InChIKey
KDKVRZVSHYAJNN-UHFFFAOYSA-N- Molecular formula
- C26H19FN2O2
- Average molar mass
- 410.4 g/mol
- Monoisotopic mass
- 410.14305602
Names & identifiers
- Preferred name
- 3,4-bis(Benzyloxy)-6-[(2-fluorophenyl)ethynyl]pyridazine
- IUPAC
- 6-[2-(2-fluorophenyl)ethynyl]-3,4-bis(phenylmethoxy)pyridazine
Names & synonyms
SCHEMBL14718411KDKVRZVSHYAJNN-UHFFFAOYSA-N3,4-bis(Benzyloxy)-6-[(2-fluorophenyl)ethynyl]pyridazine
Database identifiers
- PubChem CID
- 71269831
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 44.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 591
Related reactions
1 records
Compound notes
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