Basic information
- Standard SMILES
CCOC(=O)CNC(=O)CCS(=O)(=O)Nc1ccc(F)cc1C(F)(F)F- InChIKey
YMPDKMVGQUBMKS-UHFFFAOYSA-N- Molecular formula
- C14H16F4N2O5S
- Average molar mass
- 400.35 g/mol
Names & identifiers
- Preferred name
- 2-[3-[N-(4-Fluoro-2-trifluoromethylphenyl)sulfamoyl]propionylamino]acetic Acid Ethyl Ester
- IUPAC
- ethyl 2-[3-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfamoyl]propanoylamino]acetate
Names & synonyms
2-[3-[N-(4-Fluoro-2-trifluoromethylphenyl)sulfamoyl]propionylamino]acetic Acid Ethyl EsterSCHEMBL9502941
Database identifiers
- PubChem CID
- 54516207
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 591
Related reactions
2 records
Compound notes
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