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Basic information
- Standard SMILES
COC(=O)C[C@@H]1COc2cc(O[C@@H]3CCc4c(Oc5ccccc5)ccc(F)c43)ccc21- InChIKey
BBPZKFWROLCWNC-WAIKUNEKSA-N- Molecular formula
- C26H23FO5
- Average molar mass
- 434.5 g/mol
Names & identifiers
- Preferred name
- {(S)-6-[(R)-7-Fluoro-4-phenoxy-indan-1-yloxy]-2,3-dihydro-benzofuran-3-yl}-acetic acid methyl ester
- IUPAC
- methyl 2-[(3S)-6-[[(1R)-7-fluoro-4-phenoxy-2,3-dihydro-1H-inden-1-yl]oxy]-2,3-dihydro-1-benzofuran-3-yl]acetate
Names & synonyms
SCHEMBL15737888BBPZKFWROLCWNC-WAIKUNEKSA-N{(S)-6-[(R)-7-Fluoro-4-phenoxy-indan-1-yloxy]-2,3-dihydro-benzofuran-3-yl}-acetic acid methyl ester
Database identifiers
- PubChem CID
- 86720105
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 638
Related reactions
2 records
Compound notes
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