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(+/-)-tert-Butyl 1-(1-(4-fluorobenzyl)-1H-imidazol-2-yl)-2-(7-methyl-2-((2-(trimethylsilyl)ethoxy)methyl)-2H-indazol-5-yl)ethylcarbamate

HCID 57794667
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(CC(NC(=O)OC(C)(C)C)c2nccn2Cc2ccc(F)cc2)cc2cn(COCC[Si](C)(C)C)nc12
InChIKey
JSNRCUICPUFHTB-UHFFFAOYSA-N
Molecular formula
C31H42FN5O3Si
Average molar mass
579.8 g/mol

Names & identifiers

Preferred name
(+/-)-tert-Butyl 1-(1-(4-fluorobenzyl)-1H-imidazol-2-yl)-2-(7-methyl-2-((2-(trimethylsilyl)ethoxy)methyl)-2H-indazol-5-yl)ethylcarbamate
IUPAC
tert-butyl N-[1-[1-[(4-fluorophenyl)methyl]imidazol-2-yl]-2-[7-methyl-2-(2-trimethylsilylethoxymethyl)indazol-5-yl]ethyl]carbamate

Names & synonyms

SCHEMBL13756211JSNRCUICPUFHTB-UHFFFAOYSA-N(+/-)-tert-Butyl 1-(1-(4-fluorobenzyl)-1H-imidazol-2-yl)-2-(7-methyl-2-((2-(trimethylsilyl)ethoxy)methyl)-2H-indazol-5-yl)ethylcarbamate

Database identifiers

PubChem CID
57794667

Properties

Computed structural propertiesFilling in

Topological polar surface area
83.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
13
Heavy atoms
41
Formal charge
0
Complexity
832

Related reactions

2 records
New reaction record
HRID 1228185 reaction equation
HRID 1228185As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 2099787 reaction equation
HRID 2099787As productuspto-grants-2009_08

Compound notes

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