Basic information
- Standard SMILES
COC(=O)C[C@@H]1COc2cc(O[C@@H]3CCc4c(-c5c(C)cc(OCc6ccn(C)c(=O)c6)cc5C)ccc(F)c43)ccc21- InChIKey
XZTHHGAZJCBECM-WVXBCFDCSA-N- Molecular formula
- C35H34FNO6
- Average molar mass
- 583.6 g/mol
- Monoisotopic mass
- 583.23701597
Names & identifiers
- Preferred name
- Methyl 2-((S)-6-((R)-4-(2,6-dimethyl-4-((1-methyl-2-oxo-1,2-dihydropyridin-4-yl)methoxy)phenyl)-7-fluoro-2,3-dihydro-1H-inden-1-yloxy)-2,3-dihydrobenzofuran-3-yl)acetate
- IUPAC
- methyl 2-[(3S)-6-[[(1R)-4-[2,6-dimethyl-4-[(1-methyl-2-oxo-4-pyridinyl)methoxy]phenyl]-7-fluoro-2,3-dihydro-1H-inden-1-yl]oxy]-2,3-dihydro-1-benzofuran-3-yl]acetate
Names & synonyms
SCHEMBL15262833XZTHHGAZJCBECM-WVXBCFDCSA-NMethyl 2-((S)-6-((R)-4-(2,6-dimethyl-4-((1-methyl-2-oxo-1,2-dihydropyridin-4-yl)methoxy)phenyl)-7-fluoro-2,3-dihydro-1H-inden-1-yloxy)-2,3-dihydrobenzofuran-3-yl)acetate
Database identifiers
- PubChem CID
- 86697362
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,070
Related reactions
1 records
Compound notes
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