Basic information
- Standard SMILES
COC(=O)C[C@@H]1COc2cc(O[C@@H]3CCc4c(-c5c(C)cc(OCCNC(=O)OC(C)(C)C)cc5C)ccc(F)c43)ccc21- InChIKey
UDULJPPQWBZJJJ-KPURRNSFSA-N- Molecular formula
- C35H40FNO7
- Average molar mass
- 605.7 g/mol
Names & identifiers
- Preferred name
- Methyl 2-((S)-6-((R)-4-(4-(2-(tert-butoxycarbonylamino)ethoxy)-2,6-dimethylphenyl)-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-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]phenyl]-7-fluoro-2,3-dihydro-1H-inden-1-yl]oxy]-2,3-dihydro-1-benzofuran-3-yl]acetate
Names & synonyms
SCHEMBL15262507UDULJPPQWBZJJJ-KPURRNSFSA-NMethyl 2-((S)-6-((R)-4-(4-(2-(tert-butoxycarbonylamino)ethoxy)-2,6-dimethylphenyl)-7-fluoro-2,3-dihydro-1H-inden-1-yloxy)-2,3-dihydrobenzofuran-3-yl)acetate
Database identifiers
- PubChem CID
- 86697192
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 12
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 961
Related reactions
1 records
Compound notes
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