Basic information
- Standard SMILES
FS(F)(F)(F)(F)c1ccc(/C=C/c2nc(COc3ccc(CCCCc4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nn4)cc3)co2)cc1- InChIKey
JZVJSPLRZNWFSA-RMLRFSFXSA-N- Molecular formula
- C43H37F5N4O2S
- Average molar mass
- 768.8 g/mol
Names & identifiers
- Preferred name
- 4-[4-(4-{2-[(E)-2-(-4-Pentafluorosulfanyl-phenyl)-vinyl]-oxazol-4-ylmethoxy}-phenyl)-butyl]-1-trityl-1H-[1,2,3]triazole
- IUPAC
- pentafluoro-[4-[(E)-2-[4-[[4-[4-(1-trityltriazol-4-yl)butyl]phenoxy]methyl]-1,3-oxazol-2-yl]ethenyl]phenyl]-λ6-sulfane
Names & synonyms
SCHEMBL27673046JZVJSPLRZNWFSA-RMLRFSFXSA-N4-[4-(4-{2-[(E)-2-(-4-Pentafluorosulfanyl-phenyl)-vinyl]-oxazol-4-ylmethoxy}-phenyl)-butyl]-1-trityl-1H-[1,2,3]triazole
Database identifiers
- PubChem CID
- 23614549
Properties
Computed structural properties
- XLogP
- 13.1
- Topological polar surface area
- 67 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 1,160
Related reactions
2 records
Compound notes
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