4-(2H-1,3-Benzodioxol-5-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}-1H,4H,5H-indeno[1,2-d]pyrimidin-5-one

Catalog No. :
ACQLVR458
CAS No. :
861211-16-7
Molecular Formula :
C25H17FN2O3S
Molecular Weight :
444.49

IUPAC Name:4-(benzo[d][1,3]dioxol-5-yl)-2-((2-fluorobenzyl)thio)-1,4-dihydro-5H-indeno[1,2-d]pyrimidin-5-one

4-(2H-1,3-Benzodioxol-5-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}-1H,4H,5H-indeno[1,2-d]pyrimidin-5-one structure diagram
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Product Information

Product Name4-(2H-1,3-Benzodioxol-5-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}-1H,4H,5H-indeno[1,2-d]pyrimidin-5-one
IUPAC Name4-(benzo[d][1,3]dioxol-5-yl)-2-((2-fluorobenzyl)thio)-1,4-dihydro-5H-indeno[1,2-d]pyrimidin-5-one
MDL No.MFCD04124976
Molecular FormulaC25H17FN2O3S
Molecular Weight444.49
SMILESO=C1C2=C(C3=C1C(C4=CC=C(OCO5)C5=C4)N=C(SCC6=CC=CC=C6F)N3)C=CC=C2
InChI KeyIERBLXBUYYMVPN-UHFFFAOYSA-N
Synonym4-(1,3-BENZODIOXOL-5-YL)-2-[(2-FLUOROBENZYL)SULFANYL]-1,4-DIHYDRO-5H-INDENO[1,2-D]PYRIMIDIN-5-ONE;4-(2H-1,3-benzodioxol-5-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}-1H,4H,5H-indeno[1,2-d]pyrimidin-5-one;5H-Indeno[1,2-d]pyrimidin-5-one, 4-(1,3-benzodioxol-5-yl)-2-[[(2-fluorophenyl)methyl]thio]-1,4-dihydro-
CAS No.861211-16-7

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Synthetic Route by SureRoute

1. ACQLVR458 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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  4. Then
  5. ACQLVR458 route product structure diagram
    ACQLVR458861211-16-7
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2. ACQLVR458 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. ACQLVR458 route product structure diagram
    ACQLVR458861211-16-7
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