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Basic information
- Standard SMILES
CC(C)OC(=O)COc1ccc(F)c(NCc2cc(O)cc(-c3cccc(F)c3)c2)c1F- InChIKey
XDMONFKSSKQORP-UHFFFAOYSA-N- Molecular formula
- C24H22F3NO4
- Average molar mass
- 445.4 g/mol
Names & identifiers
- Preferred name
- Isopropyl 2-[2,4-difluoro-3-[[3-(3-fluorophenyl)-5-hydroxy-phenyl]methylamino]phenoxy]acetate
- IUPAC
- propan-2-yl 2-[2,4-difluoro-3-[[3-(3-fluorophenyl)-5-hydroxyphenyl]methylamino]phenoxy]acetate
Names & synonyms
SCHEMBL14786456XDMONFKSSKQORP-UHFFFAOYSA-NIsopropyl 2-[2,4-difluoro-3-[[3-(3-fluorophenyl)-5-hydroxy-phenyl]methylamino]phenoxy]acetate
Database identifiers
- PubChem CID
- 89445486
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 596
Related reactions
1 records
Compound notes
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