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3-[((1S)-2-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-5-hydroxy-N-(1-methyl-1H-pyrazol-3-yl)benzamide

HCID 53629632
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
C[C@@H](CO[Si](C)(C)C(C)(C)C)Oc1cc(O)cc(C(=O)Nc2ccn(C)n2)c1
InChIKey
IGPFWRDLUFBZNJ-AWEZNQCLSA-N
Molecular formula
C20H31N3O4Si
Average molar mass
405.6 g/mol
Monoisotopic mass
405.20838301

Names & identifiers

Preferred name
3-[((1S)-2-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-5-hydroxy-N-(1-methyl-1H-pyrazol-3-yl)benzamide
IUPAC
3-[(2S)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]oxy-5-hydroxy-N-(1-methylpyrazol-3-yl)benzamide

Names & synonyms

SCHEMBL1426966IGPFWRDLUFBZNJ-AWEZNQCLSA-N3-[((1S)-2-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-5-hydroxy-N-(1-methyl-1H-pyrazol-3-yl)benzamide3-((1S)-2-{[tert-butyl(dimethyl)silyl]oxy}-1-methylethyloxy)-5-hydroxy-N-(1-methyl-1H-pyrazol-3-yl)benzamide

Database identifiers

PubChem CID
53629632

Properties

Computed structural properties

Topological polar surface area
85.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
28
Formal charge
0
Complexity
526

Related reactions

18 records
New reaction record
HRID 20508 reaction equation
HRID 20508As reactantuspto-grants-2010_06
HRID 20509 reaction equation
HRID 20509As productuspto-grants-2010_06
HRID 20512 reaction equation
HRID 20512As reactantuspto-grants-2010_06
HRID 20529 reaction equation
HRID 20529As reactantuspto-grants-2010_06
HRID 20568 reaction equation
HRID 20568As reactantuspto-grants-2010_06
HRID 20597 reaction equation
HRID 20597As reactantuspto-grants-2010_06
HRID 548646 reaction equation
HRID 548646As reactantuspto-grants-2011_05
HRID 548647 reaction equation
HRID 548647As productuspto-grants-2011_05
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Compound notes

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