Basic information
- CAS
941985-34-8- Standard SMILES
CC1(C)Cc2cccc(OCC(=O)Nc3ccccc3C(F)(F)F)c2O1- InChIKey
LUBHFEJJZGIJNW-UHFFFAOYSA-N- Molecular formula
- C19H18F3NO3
- Average molar mass
- 365.3 g/mol
- Monoisotopic mass
- 365.12387792
Names & identifiers
- Preferred name
- 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[2-(trifluoromethyl)phenyl]acetamide
- IUPAC
- 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[2-(trifluoromethyl)phenyl]acetamide
Names & synonyms
941985-34-82-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-N-[2-(trifluoromethyl)phenyl]acetamide2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[2-(trifluoromethyl)phenyl]acetamideF2205-01162-((2,2-dimethyl-2,3-dihydrobenzofuran-7-yl)oxy)-N-(2-(trifluoromethyl)phenyl)acetamideMLS001129932CHEMBL1469248DTXSID301326672HMS2983B03SMSSF-0045558AKOS007951436SMR000706032
Show more names
Z19027924N-o-(trifluoromethyl)phenyl(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yloxy)acetamide
Database identifiers
- CAS
941985-34-8- PubChem CID
- 8551640
- DTXSID
DTXSID301326672- ChEMBL
CHEMBL1469248
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 509
Experimental & physicochemical properties
Solubility7.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…