1-(1,3-Benzodioxol-5-yl)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-en-1-one
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Basic information
- Standard SMILES
COc1cc(C=CC(=O)c2ccc3c(c2)OCO3)ccc1OCc1ccccc1- InChIKey
YLBVODVZACGUFZ-UHFFFAOYSA-N- Molecular formula
- C24H20O5
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.13107373
Names & identifiers
- Preferred name
- 1-(1,3-Benzodioxol-5-yl)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-en-1-one
- IUPAC
- 1-(1,3-benzodioxol-5-yl)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-en-1-one
Database identifiers
- PubChem CID
- 307193
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 555
Related reactions
0 records
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Compound notes
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