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Sembragiline

CAT: 0013-GTR19196522-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196522-02Size:2 mg
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Description
Sembragiline (EVT-302) is a potent and selective monoamine oxidase B (MAO-B) inhibitor used in Alzheimer's disease research. It has been applied in both in vitro enzymatic assays and in vivo models to investigate its potential neuroprotective effects and modulation of neurotransmitter levels.
CAS Number
676479-06-4
Product Name Alternative
MAO-B, EVT 302, EVT302, EVT-302, Sembragiline, RO 4602522, RO4602522, RO-4602522, RG 1577, RG1577, RG-1577
Field of Research
Immunology & Inflammation, Metabolism Research, Neuroscience, Signal Transduction
Purity
99.49% (May vary between batches)
Smiles
O=C1N (C[C@@H] (NC (C) =O) C1) C2=CC=C (OCC3=CC (F) =CC=C3) C=C2
Molecular Formula
C19H19FN2O3
Molecular Weight
342.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Sembragiline

Sembragiline is a small molecule drug. The usage of the INN stem '-giline' in the name indicates that Sembragiline is a monoamine oxydase (MAO)-inhibitor type B. Sembragiline has a monoisotopic molecular weight of 342.14 Da.

CAS Number676479-06-4
PubChem CID10246762
IUPAC NameN-[(3S)-1-[4-[(3-fluorophenyl)methoxy]phenyl]-5-oxopyrrolidin-3-yl]acetamide
Molecular FormulaC19H19FN2O3
Molecular Weight342.4
XLogP1.9
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity479
SMILES
CC(=O)N[C@H]1CC(=O)N(C1)C2=CC=C(C=C2)OCC3=CC(=CC=C3)F
InChI
InChI=1S/C19H19FN2O3/c1-13(23)21-16-10-19(24)22(11-16)17-5-7-18(8-6-17)25-12-14-3-2-4-15(20)9-14/h2-9,16H,10-12H2,1H3,(H,21,23)/t16-/m0/s1
InChIKey
VMAVCCUQTALHOB-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of Sembragiline
CAS: 676479-06-4
CID: 10246762
Formula: C19H19FN2O3
MW: 342.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.4
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass342.13797063
Monoisotopic Mass342.13797063
Topological Polar Surface Area58.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity479
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T28750-01Sembragiline
466019-01Sembragiline discontinued

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