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Semagacestat structure, CAS 425386-60-3

Semagacestat

CAS Number425386-60-3

SynonymsLY450139; Semagacestat

Molecular FormulaC19H27N3O4

Molecular Weight361.44

Purity≥98 (HPLC)%

Density1.2±0.1 g/cm3

Boiling Point681.9±55.0 °C at 760 mmHg

Melting Point208-212°C

Flash Point

Appearancepowder

EINECS

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Cat. No.: 2A-9057140 Purity: ≥98 (HPLC)%
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Quality Control of [ 425386-60-3 ] Purity: ≥98 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number425386-60-3
Catalog No.2A-9057140
Chinese Name司马西特
SynonymsLY450139; Semagacestat
Molecular FormulaC19H27N3O4
Molecular Weight361.44
Purity≥98 (HPLC)
Density1.2±0.1 g/cm3
Boiling Point681.9±55.0 °C at 760 mmHg
Melting Point208-212°C
Appearancepowder
Storage Condition2-8°C
ApplicationSemagacestat is a γ-secretase inhibitor that inhibits β-amyloid (Aβ42), Aβ38 and Aβ40 with IC50 of 10.9, 12 and 12.1 nM respectively. Also inhibits Notch with an IC50 of 14.1 nM.
MDL NumberMFCD09970409
SMILESO=C([C@@H](NC([C@@H](O)C(C)C)=O)C)N[C@@H](C1=CC=CC=C1CCN2C)C2=O
InChI1S/C19H27N3O4/c1-11(2)16(23)18(25)20-12(3)17(24)21-15-14-8-6-5-7-13(14)9-10-22(4)19(15)26/h5-8,11-12,15-16,23H,9-10H2,1-4H3,(H,20,25)(H,21,24)/t12-,15-,16-/m0/s1
InChI KeyPKXWXXPNHIWQHW-RCBQFDQVSA-N
NACRES CodeNA.77
UNSPSC12352200
MSDSmsds/57140_1_425386_60_3.pdf
Transport InfoProduct name: Semagacestat(LY450139)
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