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Anle138b

CAT: 0013-GTR19158125-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19158125-06Size:50 mg
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Description
Anle138b: a novel oligomer modulator for disease-modifying therapy of neurodegenerative diseases such as prion and Parkinson’s disease.
CAS Number
882697-00-9
Purity
>98% (HPLC)
Solubility
DMSO:50 mg/mL (145.70 mM)
Smiles
C1OC2=C (O1) C=C (C=C2) C3=CC (=NN3) C4=CC (=CC=C4) Br
Molecular Formula
C16H11BrN2O2?
Molecular Weight
343.17
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
5- (13-Benzodioxol-5-yl) -3- (3-bromophenyl) -1H-pyrazole

Chemical Information

Emrusolmin

Anle138b is emrusolmin restores hippocampal synaptic and transcriptional plasticity as well as spatial memory in a mouse model for Alzheimer's disease, when given orally before or after the onset of pathology.

CAS Number882697-00-9
PubChem CID44608289
IUPAC Name5-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-1H-pyrazole
Molecular FormulaC16H11BrN2O2
Molecular Weight343.17
XLogP4
Topological Polar Surface Area47.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity370
SMILES
C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3)C4=CC(=CC=C4)Br
InChI
InChI=1S/C16H11BrN2O2/c17-12-3-1-2-10(6-12)13-8-14(19-18-13)11-4-5-15-16(7-11)21-9-20-15/h1-8H,9H2,(H,18,19)
InChIKey
RCQIIBJSUWYYFU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Emrusolmin
CAS: 882697-00-9
CID: 44608289
Formula: C16H11BrN2O2
MW: 343.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight343.17
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass342.00039
Monoisotopic Mass342.00039
Topological Polar Surface Area47.1 Ų
Heavy Atom Count21
Formal Charge0
Complexity370
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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