Methyl 2-[2,4-difluoro-3-[[2-fluoro-5-(3-fluorophenyl)phenyl]methylamino]phenoxy]acetate
Basic information
- Standard SMILES
COC(=O)COc1ccc(F)c(NCc2cc(-c3cccc(F)c3)ccc2F)c1F- InChIKey
MSBGLKDWLVULRI-UHFFFAOYSA-N- Molecular formula
- C22H17F4NO3
- Average molar mass
- 419.4 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[2,4-difluoro-3-[[2-fluoro-5-(3-fluorophenyl)phenyl]methylamino]phenoxy]acetate
- IUPAC
- methyl 2-[2,4-difluoro-3-[[2-fluoro-5-(3-fluorophenyl)phenyl]methylamino]phenoxy]acetate
Names & synonyms
SCHEMBL14774978MSBGLKDWLVULRI-UHFFFAOYSA-Nmethyl 2-[2,4-difluoro-3-[[2-fluoro-5-(3-fluorophenyl)phenyl]methylamino]phenoxy]acetate
Database identifiers
- PubChem CID
- 71515519
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 554
Related reactions
1 records
Compound notes
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