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N-Pyridin-2-ylmethyl-4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzimidazol-2-ylmethyl]-amino}-methyl)-benzenesulfonamide

HCID 68899533
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C[Si](C)(C)CCOCn1c(CN(Cc2ccc(S(=O)(=O)NCc3ccccn3)cc2)C2CCCc3cccnc32)nc2ccccc21
InChIKey
NLWROUWMHZASPL-UHFFFAOYSA-N
Molecular formula
C36H44N6O3SSi
Average molar mass
668.9 g/mol

Names & identifiers

Preferred name
N-Pyridin-2-ylmethyl-4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzimidazol-2-ylmethyl]-amino}-methyl)-benzenesulfonamide
IUPAC
N-(pyridin-2-ylmethyl)-4-[[5,6,7,8-tetrahydroquinolin-8-yl-[[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]methyl]amino]methyl]benzenesulfonamide

Names & synonyms

SCHEMBL4067630NLWROUWMHZASPL-UHFFFAOYSA-NN-Pyridin-2-ylmethyl-4-({(5,6,7,8-tetrahydro-quinolin-8-yl)-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzimidazol-2-ylmethyl]-amino}-methyl)-benzenesulfonamide

Database identifiers

PubChem CID
68899533

Properties

Computed structural properties

Topological polar surface area
111 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
14
Heavy atoms
47
Formal charge
0
Complexity
1,060

Related reactions

3 records
New reaction record
HRID 160127 reaction equation
HRID 160127As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 970897 reaction equation
HRID 970897As productuspto-grants-2007_12
HRID 2308275 reaction equation
HRID 2308275As productuspto-grants-2004_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes