2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide
Basic information
- CAS
100279-02-5- Standard SMILES
Cc1cc(SC(F)(F)C(F)F)ccc1NC(=O)NC(=O)c1c(F)cccc1F- InChIKey
UZEFSCUGGLZEIR-UHFFFAOYSA-N- Molecular formula
- C17H12F6N2O2S
- Average molar mass
- 422.3 g/mol
- Monoisotopic mass
- 422.05236778
Names & identifiers
- Preferred name
- 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide
- IUPAC
- 2,6-difluoro-N-[[2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl]carbamoyl]benzamide
Names & synonyms
100279-02-52,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamideCHEMBL2287846DTXSID401430862,6-Difluoro-N-({2-methyl-4-[(1,1,2,2-tetrafluoroethyl)sulfanyl]phenyl}carbamoyl)benzamideBenzamide, 2,6-difluoro-N-[[[2-methyl-4-[(1,1,2,2-tetrafluoroethyl)thio]phenyl]amino]carbonyl]-?
Database identifiers
- CAS
100279-02-5- PubChem CID
- 180795
- DTXSID
DTXSID40143086- ChEMBL
CHEMBL2287846- Nikkaji
- J467.991A
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 558
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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