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LY2811376

CAT: 1410-M10676-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M10676-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent, orally available non-peptidic β-secretase (BACE1) inhibitor with IC50 of 239 nM in enzyme assays.
CAS Number
1194044-20-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
320.3603
Molecular Formula
C15H14F2N4S
Notes
Research use only, not for human use.
Receptor
Aβ|BACE1

Chemical Information

Ly-2811376

LY2811376 has been used in trials studying the basic science of Alzheimer's Disease.

CAS Number1194044-20-6
PubChem CID44251605
IUPAC Name(4S)-4-(2,4-difluoro-5-pyrimidin-5-ylphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine
Molecular FormulaC15H14F2N4S
Molecular Weight320.4
XLogP2.1
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity430
SMILES
C[C@]1(CCSC(=N1)N)C2=C(C=C(C(=C2)C3=CN=CN=C3)F)F
InChI
InChI=1S/C15H14F2N4S/c1-15(2-3-22-14(18)21-15)11-4-10(12(16)5-13(11)17)9-6-19-8-20-7-9/h4-8H,2-3H2,1H3,(H2,18,21)/t15-/m0/s1
InChIKey
MJQMRGWYPNIERM-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of Ly-2811376
CAS: 1194044-20-6
CID: 44251605
Formula: C15H14F2N4S
MW: 320.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.4
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass320.09072396
Monoisotopic Mass320.09072396
Topological Polar Surface Area89.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity430
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
T2639-01LY2811376
A11776-100LY2811376 100mg

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