Basic information
- Standard SMILES
C(=C\c1nc(COc2ccc(CCCn3cnc4ccccc43)cc2)co1)/c1ccccc1- InChIKey
JPSYQFDQGIJYKU-SAPNQHFASA-N- Molecular formula
- C28H25N3O2
- Average molar mass
- 435.5 g/mol
- Monoisotopic mass
- 435.19467705
Names & identifiers
- Preferred name
- 1-[3-[4-[2-[(E)-2-phenylethenyl]-4-oxazolylmethoxy]phenyl]propyl]benzimidazole
- IUPAC
- 4-[[4-[3-(benzimidazol-1-yl)propyl]phenoxy]methyl]-2-[(E)-2-phenylethenyl]-1,3-oxazole
Names & synonyms
SCHEMBL5763159JPSYQFDQGIJYKU-SAPNQHFASA-N1-[3-[4-[2-[(E)-2-phenylethenyl]-4-oxazolylmethoxy]phenyl]propyl]benzimidazole
Database identifiers
- PubChem CID
- 22009733
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 600
Related reactions
1 records
Compound notes
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