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Dapt

CAS No.:
208255-80-5
Catalog Number:
AG002JLH
Molecular Formula:
C23H26F2N2O4
Molecular Weight:
432.4603
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
95%
In Stock USA
United States
$112
- +
10mg
95%
In Stock USA
United States
$179
- +
50mg
95%
In Stock USA
United States
$313
- +
100mg
95%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG002JLH
Chemical Name:
Dapt
CAS Number:
208255-80-5
Molecular Formula:
C23H26F2N2O4
Molecular Weight:
432.4603
MDL Number:
MFCD04974585
IUPAC Name:
tert-butyl (2S)-2-[[(2S)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoyl]amino]-2-phenylacetate
InChI:
InChI=1S/C23H26F2N2O4/c1-14(26-19(28)12-15-10-17(24)13-18(25)11-15)21(29)27-20(16-8-6-5-7-9-16)22(30)31-23(2,3)4/h5-11,13-14,20H,12H2,1-4H3,(H,26,28)(H,27,29)/t14-,20-/m0/s1
InChI Key:
DWJXYEABWRJFSP-XOBRGWDASA-N
SMILES:
O=C(N[C@H](C(=O)NC(c1ccccc1)C(=O)OC(C)(C)C)C)Cc1cc(F)cc(c1)F
Properties
Complexity:
622  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
432.186g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
432.468g/mol
Monoisotopic Mass:
432.186g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Diamide amino-imidazoles: a novel series of γ-secretase inhibitors for the treatment of Alzheimer's disease. Bioorganic & medicinal chemistry letters 20110501
Development of photoaffinity probes for gamma-secretase equipped with a nitrobenzenesulfonamide-type cleavable linker. Bioorganic & medicinal chemistry letters 20091215
Discovery of begacestat, a Notch-1-sparing gamma-secretase inhibitor for the treatment of Alzheimer's disease. Journal of medicinal chemistry 20081211
Signal peptide peptidase and gamma-secretase share equivalent inhibitor binding pharmacology. The Journal of biological chemistry 20071221
Insensitivity to Abeta42-lowering nonsteroidal anti-inflammatory drugs and gamma-secretase inhibitors is common among aggressive presenilin-1 mutations. The Journal of biological chemistry 20070824
Properties