Basic information
- Standard SMILES
C=Cc1c(OC)ccc2cc(C(O)(c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)C(C)C)ccc12- InChIKey
YQQHQHAOSIQTDX-UHFFFAOYSA-N- Molecular formula
- C39H36N2O2
- Average molar mass
- 564.7 g/mol
- Monoisotopic mass
- 564.2776784
Names & identifiers
- Preferred name
- 1-(5-Ethenyl-6-methoxynaphthalen-2-yl)-1-(1-trityl-1H-imidazol-4-yl)-2-methyl-1-propanol
- IUPAC
- 1-(5-ethenyl-6-methoxynaphthalen-2-yl)-2-methyl-1-(1-tritylimidazol-4-yl)propan-1-ol
Names & synonyms
SCHEMBL5751100YQQHQHAOSIQTDX-UHFFFAOYSA-N1-(5-Ethenyl-6-methoxynaphthalen-2-yl)-1-(1-trityl-1H-imidazol-4-yl)-2-methyl-1-propanol
Database identifiers
- PubChem CID
- 22018366
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 842
Related reactions
3 records
Compound notes
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