2,6-Difluoro-N-((2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)benzamide
Basic information
- CAS
100341-42-2- Standard SMILES
O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(S(=O)C(F)(F)C(F)F)cc1F- InChIKey
RVQSTZNBXXJVHY-UHFFFAOYSA-N- Molecular formula
- C16H9F7N2O3S
- Average molar mass
- 442.3 g/mol
- Monoisotopic mass
- 442.02221046
Names & identifiers
- Preferred name
- 2,6-Difluoro-N-((2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)benzamide
- IUPAC
- 2,6-difluoro-N-[[2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl]carbamoyl]benzamide
Names & synonyms
100341-42-22,6-Difluoro-N-((2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)benzamideCHEMBL2287840DTXSID809054032,6-Difluoro-N-[{[2-fluoro-4-(1,1,2,2-tetrafluoroethanesulfinyl)phenyl]imino}(hydroxy)methyl]benzene-1-carboximidic acidBenzamide, 2,6-difluoro-N-[[[2-fluoro-4-[(1,1,2,2-tetrafluoroethyl)sulfinyl]phenyl]amino]carbonyl]-
Database identifiers
- CAS
100341-42-2- PubChem CID
- 180844
- DTXSID
DTXSID80905403- ChEMBL
CHEMBL2287840- Nikkaji
- J467.985G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 630
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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