Basic information
- Standard SMILES
C[Si](C)(C)CCOCn1nc(B(O)O)cc(-c2nc3ccc(C(F)(F)F)cc3n2COCC[Si](C)(C)C)c1=O- InChIKey
SPCUQIGRXSPCLT-UHFFFAOYSA-N- Molecular formula
- C24H36BF3N4O5Si2
- Average molar mass
- 584.5 g/mol
Names & identifiers
- Preferred name
- 6-Oxo-5-[6-tri-fluoromethyl-1-(2-trimethylsilanylethoxymethyl)-1H-benzimidazol-2-yl]-1-(2-trimethylsilanylethoxymethyl)-1,6-dihydropyridazine-3-boronic acid
- IUPAC
- [6-oxo-5-[6-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]-1-(2-trimethylsilylethoxymethyl)pyridazin-3-yl]boronic acid
Names & synonyms
6-Oxo-5-[6-tri-fluoromethyl-1-(2-trimethylsilanylethoxymethyl)-1H-benzimidazol-2-yl]-1-(2-trimethylsilanylethoxymethyl)-1,6-dihydropyridazine-3-boronic acidSCHEMBL3536142
Database identifiers
- PubChem CID
- 68680596
Properties
Computed structural properties
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 927
Related reactions
3 records
Compound notes
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