Basic information
- Standard SMILES
C=CCN(C)CC=CCOc1ccc2c(-c3ccc(Br)cc3)coc2c1- InChIKey
KCNKJCHARANTIP-UHFFFAOYSA-N- Molecular formula
- C22H22BrNO2
- Average molar mass
- 412.3 g/mol
Names & identifiers
- Preferred name
- 4-[[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy]-N-methyl-N-prop-2-enylbut-2-en-1-amine
- IUPAC
- 4-[[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy]-N-methyl-N-prop-2-enylbut-2-en-1-amine
Names & synonyms
SCHEMBL4314974SCHEMBL30583132PD040840
Database identifiers
- PubChem CID
- 68999732
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 25.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 461
Related reactions
1 records
Compound notes
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