5-(((2R,3R)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

Catalog No.: 
ACRUNH930
CAS No.: 
1148113-53-4
Molecular Formula: 
C23H21F7N4O3
Molecular Weight: 
534.43
5-(((2R,3R)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one structure diagram
Pack SizePurityList PriceYour PriceGlobal StockUS StockQuantity
100mg98%$402.00InquiryInquiry
250mg98%$756.00InquiryInquiry
1g98%$2994.00InquiryInquiry

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Product Information

Product Name5-(((2R,3R)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
IUPAC Name5-(((2R,3R)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
MDL No.MFCD23704633
Molecular FormulaC23H21F7N4O3
Molecular Weight534.43
SMILESO=C1NC(CN2CCO[C@H](O[C@H](C)C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)[C@]2(C4=CC=C(F)C=C4)[H])=NN1
InChI KeyATALOFNDEOCMKK-TVNIXMEMSA-N
Synonym(R,R,R)-Aprepitant;Aprepitant trans-1-enantiomer;Aprepitant Related Compound A (10 mg) (3-[[(2R,3R)-2-[(R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholino]methyl]-1H-1,2,4-triazol-5(4H)-one);5-[[(2R,3R)-2-[(1R)-1-[3,5-Bis(trifluoroMethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-Morpholinyl]Methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one;Aprepitant Related CoMpound A;Aprepitant EP Impurity E;Aprepitant A;Aprepitant USP RC A (R,R,R-Diasteromer)
CAS No.1148113-53-4

Synthetic Route by SureRoute

1. ACRUNH930 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  5. ACRUNH930 route product structure diagram
    ACRUNH9301148113-53-4
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2. ACRUNH930 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACRUNH930 route product structure diagram
    ACRUNH9301148113-53-4
Inquiry

3. ACRUNH930 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACRUNH930 route product structure diagram
    ACRUNH9301148113-53-4
Inquiry

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