3-[4-methoxymethyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-yl]-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridine

HCID 57581113
Substructure searchFind similar structures

Basic information

Standard SMILES
COCc1cccc2c1nc(-c1nn(COCC[Si](C)(C)C)c3ncc(B4OC(C)(C)C(C)(C)O4)cc13)n2COCC[Si](C)(C)C
InChIKey
YDYSDQGVOAVTFV-UHFFFAOYSA-N
Molecular formula
C33H52BN5O5Si2
Average molar mass
665.8 g/mol

Names & identifiers

Preferred name
3-[4-methoxymethyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-yl]-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridine
IUPAC
2-[[4-(methoxymethyl)-2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazolo[5,4-b]pyridin-3-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane

Names & synonyms

SCHEMBL4042188YDYSDQGVOAVTFV-UHFFFAOYSA-N3-[4-methoxymethyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-yl]-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridine

Database identifiers

PubChem CID
57581113

Properties

Computed structural properties

Topological polar surface area
94.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
14
Heavy atoms
46

Related reactions

2 records
New reaction record

Linked notes

Loading…