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Basic information
- Standard SMILES
COc1c(C(=O)C=Cc2ccc(F)cc2)c(OCCN(C)C)c(OC)c2occc12- InChIKey
CCYLRFCFIKRBCZ-UHFFFAOYSA-N- Molecular formula
- C23H24FNO5
- Average molar mass
- 413.4 g/mol
- Monoisotopic mass
- 413.16385103
Names & identifiers
- Preferred name
- 1-[6-[2-(Dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(4-fluorophenyl)prop-2-en-1-one
- IUPAC
- 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(4-fluorophenyl)prop-2-en-1-one
Database identifiers
- PubChem CID
- 33457
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 61.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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