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tert-Butyl 4-((1-(6-chloro-2-oxo-1,3-bis((2-(trimethylsilyl)ethoxy)methyl)-2,3-dihydro-1H-benzo[d]imidazol-4-yl)ethoxy)methyl)-4-(4-fluorophenyl)piperidine-1-carboxylate

HCID 57546037
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Basic information

Standard SMILES
CC(OCC1(c2ccc(F)cc2)CCN(C(=O)OC(C)(C)C)CC1)c1cc(Cl)cc2c1n(COCC[Si](C)(C)C)c(=O)n2COCC[Si](C)(C)C
InChIKey
LCVUWKJXETUJPB-UHFFFAOYSA-N
Molecular formula
C38H59ClFN3O6Si2
Average molar mass
764.5 g/mol
Monoisotopic mass
763.3614955

Names & identifiers

Preferred name
tert-Butyl 4-((1-(6-chloro-2-oxo-1,3-bis((2-(trimethylsilyl)ethoxy)methyl)-2,3-dihydro-1H-benzo[d]imidazol-4-yl)ethoxy)methyl)-4-(4-fluorophenyl)piperidine-1-carboxylate
IUPAC
tert-butyl 4-[1-[6-chloro-2-oxo-1,3-bis(2-trimethylsilylethoxymethyl)benzimidazol-4-yl]ethoxymethyl]-4-(4-fluorophenyl)piperidine-1-carboxylate

Names & synonyms

SCHEMBL2429429LCVUWKJXETUJPB-UHFFFAOYSA-Ntert-Butyl 4-((1-(6-chloro-2-oxo-1,3-bis((2-(trimethylsilyl)ethoxy)methyl)-2,3-dihydro-1H-benzo[d]imidazol-4-yl)ethoxy)methyl)-4-(4-fluorophenyl)piperidine-1-carboxylate

Database identifiers

PubChem CID
57546037

Properties

Computed structural properties

Topological polar surface area
80.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
17
Heavy atoms
51
Formal charge
0
Complexity
1,130

Related reactions

2 records
New reaction record
HRID 913940 reaction equation
HRID 913940As productuspto-grants-2011_09
HRID 2137021 reaction equation
HRID 2137021As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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