MK-886 Na Salt hydrate

Catalog No. :
ACIOMF041
CAS No. :
1049737-88-3
Molecular Formula :
C27H35ClNNaO3S
Molecular Weight :
512.09

IUPAC Name:sodium 3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-isopropyl-1H-indol-2-yl)-2,2-dimethylpropanoate hydrate

MK-886 Na Salt hydrate structure diagram
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Product Information

Product NameMK-886 Na Salt hydrate
IUPAC Namesodium 3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-isopropyl-1H-indol-2-yl)-2,2-dimethylpropanoate hydrate
MDL No.MFCD11045945
Molecular FormulaC27H35ClNNaO3S
Molecular Weight512.09
SMILESO=C(C(C)(CC(N1CC2=CC=C(C=C2)Cl)=C(C3=C1C=CC(C(C)C)=C3)SC(C)(C)C)C)[O-].[Na+].O
InChI KeyAPMAGPLTTCSTMM-UHFFFAOYSA-M
Synonym1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-α,α-dimethyl-5-(1-methylethyl)-, sodium salt, hydrate (1:1:1)
CAS No.1049737-88-3

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACIOMF041 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACIOMF041 route product structure diagram
    ACIOMF0411049737-88-3
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2. ACIOMF041 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACIOMF041 route product structure diagram
    ACIOMF0411049737-88-3
Inquiry

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