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BMS 433796

CAT: 0013-GTR19203895-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203895-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BMS 433796 is a γ-secretase inhibitor that effectively reduces Aβ peptide levels. It has been utilized in both in vitro enzymatic assays and in vivo studies, including transgenic mouse models, to investigate Alzheimer's disease pathogenesis and potential therapeutic strategies.
CAS Number
935525-13-6
Product Name Alternative
Beta Amyloid, BetaAmyloid, BMS-289948, BMS-299897, BMS433796, BMS-433796, BMS 433796, b Amyloid, Aβ, bAmyloid, γ-secretase, βAmyloid, β Amyloid
Field of Research
Neuroscience, Protein Biochemistry, Stem Cell & Developmental Biology
Purity
99.17% (May vary between batches)
Smiles
N (C ([C@@H] (NC ([C@@H] (O) C1=CC (F) =CC (F) =C1) =O) C) =O) [C@H]2C=3C (C=NN (C) C2=O) =CC=CC3
Molecular Formula
C21H20F2N4O4
Molecular Weight
430.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bms-433796
CAS Number935525-13-6
PubChem CID23656215
IUPAC Name(2S)-2-[[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetyl]amino]-N-[(5S)-3-methyl-4-oxo-5H-2,3-benzodiazepin-5-yl]propanamide
Molecular FormulaC21H20F2N4O4
Molecular Weight430.4
XLogP1.3
Topological Polar Surface Area111
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity711
SMILES
C[C@@H](C(=O)N[C@H]1C2=CC=CC=C2C=NN(C1=O)C)NC(=O)[C@H](C3=CC(=CC(=C3)F)F)O
InChI
InChI=1S/C21H20F2N4O4/c1-11(25-20(30)18(28)13-7-14(22)9-15(23)8-13)19(29)26-17-16-6-4-3-5-12(16)10-24-27(2)21(17)31/h3-11,17-18,28H,1-2H3,(H,25,30)(H,26,29)/t11-,17-,18-/m0/s1
InChIKey
HXEHCCYOTHDPPI-NBHSMZAVSA-N
Chemical Structure
2D Structure
2D structure of Bms-433796
CAS: 935525-13-6
CID: 23656215
Formula: C21H20F2N4O4
MW: 430.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight430.4
XLogP31.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass430.14526146
Monoisotopic Mass430.14526146
Topological Polar Surface Area111 Ų
Heavy Atom Count31
Formal Charge0
Complexity711
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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