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Chemical structure of MZP-54

GC33102

MZP-54

Also known as (2S,4R)-1-[(2S)-2-[[2-[2-[2-[2-[[4-[(2S,4R)-1-acetyl-4-(4-chloroanilino)-2-methyl-3,4-dihydro-2H-quinolin-6-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide

MZP-54 is a PROTAC connected by ligands for von Hippel-Lindau and BRD3/4, with a Kd of 4 nM for Brd4BD2

ChemicalCAS2010159-47-2MW1036.67FormulaC55H66ClN7O9S
CAS number
2010159-47-2
Molecular weight
1036.67
Formula
C55H66ClN7O9S
Solubility
Ethanol ： 50 mg/mL (48·23 mM)
InChIKey
FYSWLIFIYIVHPI-DDWISSAJSA-N
Catalogue number
GC33102
Brand
GLPBIO
Computed properties PubChem CID 122551841 · XLogP 6.6 · TPSA 229 Ų · H-bond donors 5
XLogP
6.6
TPSA
229 Ų
H-bond donors
5
H-bond acceptors
12
Rotatable bonds
22
Heavy atoms
73

SMILES C[C@H]1C[C@H](C2=C(N1C(=O)C)C=CC(=C2)C3=CC=C(C=C3)C(=O)NCCOCCOCCOCC(=O)N[C@H](C(=O)N4C[C@@H](C[C@H]4C(=O)NCC5=CC=C(C=C5)C6=C(N=CS6)C)O)C(C)(C)C)NC7=CC=C(C=C7)Cl

Computed descriptors from PubChem (CID 122551841), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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