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Antimalarial agent 50

CAT: 0013-GTR19263635-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19263635-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Antimalarial agent 50 is a compound that acts against malaria-causing parasites. In mouse models, it is effective against Plasmodium berghei-induced malaria infections. Antimalarial agent 50 modulates oxidative stress and significantly reduces inflammatory cytokine levels. This compound is applicable in malaria research.
CAS Number
2384242-67-3
Field of Research
Infectious Disease & Virology
Smiles
O=C (N1N=C (C=C1C=2C=CC=CC2) C=3C=CC=CC3) CSC4=NC=5C=CC=CC5N4
Molecular Formula
C24H18N4OS
Molecular Weight
410.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(1H-benzimidazol-2-ylsulfanyl)-1-(3,5-diphenylpyrazol-1-yl)ethanone
CAS Number2384242-67-3
PubChem CID178203344
IUPAC Name2-(1H-benzimidazol-2-ylsulfanyl)-1-(3,5-diphenylpyrazol-1-yl)ethanone
Molecular FormulaC24H18N4OS
Molecular Weight410.5
XLogP5.6
Topological Polar Surface Area88.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity578
SMILES
C1=CC=C(C=C1)C2=CC(=NN2C(=O)CSC3=NC4=CC=CC=C4N3)C5=CC=CC=C5
InChI
InChI=1S/C24H18N4OS/c29-23(16-30-24-25-19-13-7-8-14-20(19)26-24)28-22(18-11-5-2-6-12-18)15-21(27-28)17-9-3-1-4-10-17/h1-15H,16H2,(H,25,26)
InChIKey
KJVIZZRWTABKBB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(3,5-diphenylpyrazol-1-yl)ethanone
CAS: 2384242-67-3
CID: 178203344
Formula: C24H18N4OS
MW: 410.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight410.5
XLogP35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass410.12013238
Monoisotopic Mass410.12013238
Topological Polar Surface Area88.9 Ų
Heavy Atom Count30
Formal Charge0
Complexity578
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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