Basic information
- Standard SMILES
CC(C)(C)S(=O)NC(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1Cl)C(F)(F)F- InChIKey
UKNANUABXFEGBI-UHFFFAOYSA-N- Molecular formula
- C18H26BClF3NO3S
- Average molar mass
- 439.7 g/mol
Names & identifiers
- Preferred name
- N-[1-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2,2,2-trifluoroethyl]-2-methylpropane-2-sulfinamide
- IUPAC
- N-[1-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2,2,2-trifluoroethyl]-2-methylpropane-2-sulfinamide
Names & synonyms
SCHEMBL3943918
Database identifiers
- PubChem CID
- 68848762
Properties
Computed structural properties
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 582
Related reactions
1 records
Compound notes
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