Basic information
- Standard SMILES
COC1(c2cc(F)cc(OCc3nc(-c4ccc(F)cc4)c(-c4ccc(S(C)(=O)=O)cc4)o3)c2)CCOCC1- InChIKey
GPDMJQGUIMOBJS-UHFFFAOYSA-N- Molecular formula
- C29H27F2NO6S
- Average molar mass
- 555.6 g/mol
Names & identifiers
- Preferred name
- 4-(4-Fluorophenyl)-2-[[3-fluoro-5-(3,4,5,6-tetrahydro-4-methoxy-2H-pyran-4-yl)phenoxy)methyl]-5-(4-(methylsulfonyl)phenyl)oxazole
- IUPAC
- 2-[[3-fluoro-5-(4-methoxyoxan-4-yl)phenoxy]methyl]-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazole
Names & synonyms
SCHEMBL6025420GPDMJQGUIMOBJS-UHFFFAOYSA-N4-(4-Fluorophenyl)-2-[[3-fluoro-5-(3,4,5,6-tetrahydro-4-methoxy-2H-pyran-4-yl)phenoxy)methyl]-5-(4-(methylsulfonyl)phenyl)oxazole
Database identifiers
- PubChem CID
- 9937569
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 881
Related reactions
2 records
Compound notes
Loading…