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Chemical structure of AD4

GC73236

AD4

Also known as 8-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]-N,N-bis[2-[[(1R,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]ethyl]octanamide

AD4 is an artemisinin derivative that is a proteolytic targeting chimera (PROTAC) targeting PCLAF

ChemicalCAS2918262-09-4MW1035.23FormulaC55H78N4O15
CAS number
2918262-09-4
Molecular weight
1035.23
Formula
C55H78N4O15
Solubility
DMSO ： 100 mg/mL (96·60 mM; Need ultrasonic)
InChIKey
ZLJLKXURBBWTFW-IYMVBMQZSA-N
Catalogue number
GC73236
Brand
GLPBIO
Computed properties PubChem CID 171370424 · XLogP 7.9 · TPSA 208 Ų · H-bond donors 2
XLogP
7.9
TPSA
208 Ų
H-bond donors
2
H-bond acceptors
16
Rotatable bonds
18
Heavy atoms
74

SMILES C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OCCN(CCO[C@@H]5[C@@H]([C@@H]6CC[C@H]([C@H]7[C@]68[C@H](O5)O[C@@](CC7)(OO8)C)C)C)C(=O)CCCCCCCNC9=CC=CC1=C9C(=O)N(C1=O)C1CCC(=O)NC1=O)C

Computed descriptors from PubChem (CID 171370424), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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