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Chemical structure of MCL-1/BCL-2-IN-3

GC38928

MCL-1/BCL-2-IN-3

Also known as methyl 6-[2-[6-(4-bromophenyl)sulfanyl-1,3-dioxobenzo[de]isoquinolin-2-yl]ethylamino]-6-oxohexanoate

MCL-1/BCL-2-IN-3 (Compound 2) is a potent and selective Mcl-1 and Bcl-2 dual inhibitor with IC50s of 5·95 and 4·78 μM, respectively

ChemicalCAS2163793-55-1MW569.47FormulaC27H25BrN2O5S
CAS number
2163793-55-1
Molecular weight
569.47
Formula
C27H25BrN2O5S
Solubility
DMSO： 17·86 mg/mL (31·36 mM)
InChIKey
HZZXWFWVQWMGAR-UHFFFAOYSA-N
Catalogue number
GC38928
Brand
GLPBIO
Computed properties PubChem CID 145712377 · XLogP 4.7 · TPSA 118 Ų · H-bond donors 1
XLogP
4.7
TPSA
118 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
36

SMILES COC(=O)CCCCC(=O)NCCN1C(=O)C2=C3C(=C(C=C2)SC4=CC=C(C=C4)Br)C=CC=C3C1=O

Computed descriptors from PubChem (CID 145712377), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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