Basic information
- Standard SMILES
FC(F)(F)c1ccc(C2(c3cc(OCc4ccccc4)c(OCc4ccccc4)nn3)CC2)cc1- InChIKey
GAHOCHPBADWJHL-UHFFFAOYSA-N- Molecular formula
- C28H23F3N2O2
- Average molar mass
- 476.5 g/mol
- Monoisotopic mass
- 476.17116247
Names & identifiers
- Preferred name
- 3,4-bis(Benzyloxy)-6-{1-[4-(trifluoromethyl)phenyl]-cyclopropyl}pyridazine
- IUPAC
- 3,4-bis(phenylmethoxy)-6-[1-[4-(trifluoromethyl)phenyl]cyclopropyl]pyridazine
Names & synonyms
3,4-bis(Benzyloxy)-6-{1-[4-(trifluoromethyl)phenyl]-cyclopropyl}pyridazineSCHEMBL147193103,4-bis(benzyloxy)-6-{1-[4-(trifluoromethyl)phenyl]-cyclopropyl}-pyridazine
Database identifiers
- PubChem CID
- 71270328
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 44.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 651
Related reactions
2 records
Compound notes
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