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DSM74

CAT: 0013-GTR19199282-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19199282-01Size:25 mg
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Description
DSM74 is a stable, small-molecule inhibitor of dihydroorotate dehydrogenase (DHODH) with demonstrated antimalarial properties. It is a valuable research tool for studying Plasmodium metabolism and has shown efficacy in both in vitro parasite assays and in vivo models of malaria infection.
CAS Number
898743-92-5
Field of Research
Infectious Disease & Virology
Smiles
N (C=1N2C (N=C (C) C1) =NC=N2) C3=CC=C (C (F) (F) F) C=C3
Molecular Formula
C13H10F3N5
Molecular Weight
293.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dsm-74
CAS Number898743-92-5
PubChem CID25263414
IUPAC Name5-methyl-N-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Molecular FormulaC13H10F3N5
Molecular Weight293.25
XLogP3.3
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity356
SMILES
CC1=NC2=NC=NN2C(=C1)NC3=CC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C13H10F3N5/c1-8-6-11(21-12(19-8)17-7-18-21)20-10-4-2-9(3-5-10)13(14,15)16/h2-7,20H,1H3
InChIKey
LRHHXKBKRNNFRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dsm-74
CAS: 898743-92-5
CID: 25263414
Formula: C13H10F3N5
MW: 293.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight293.25
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass293.08882983
Monoisotopic Mass293.08882983
Topological Polar Surface Area55.1 Ų
Heavy Atom Count21
Formal Charge0
Complexity356
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

Alternative Products

CatalogName
HY-119057DSM74

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