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ML385

ML385

  • CAT Number: I013677
  • CAS Number: 846557-71-9
  • Molecular Formula: C₃₁H₂₉N₃O₂S
  • Molecular Weight: 507.65
  • Purity: ≥95%
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ML385 (Cat. No: I013677) is a novel, selective NRF2 inhibitor with IC50 of 1.9 μM. It can inhibit the expression of NRF2 downstream target genes. As a key protein, NRF2 can be involved in regulating the activity of various ferroptosis and lipid peroxidation-related proteins.

Catalog Number I013677
CAS Number 846557-71-9
Molecular Formula

C₃₁H₂₉N₃O₂S

Purity 95%
Target Keap1-Nrf2
Solubility DMSO: ≥ 30 mg/mL
IUPAC Name 2-(1,3-benzodioxol-5-yl)-N-[5-methyl-4-[1-(2-methylbenzoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]acetamide
InChI InChI=1S/C29H25N3O4S/c1-17-5-3-4-6-22(17)28(34)32-12-11-20-15-21(8-9-23(20)32)27-18(2)37-29(31-27)30-26(33)14-19-7-10-24-25(13-19)36-16-35-24/h3-10,13,15H,11-12,14,16H2,1-2H3,(H,30,31,33)
InChIKey LINHYWKZVCNAMQ-UHFFFAOYSA-N
SMILES CC1=CC=CC=C1C(=O)N2CCC3=C2C=CC(=C3)C4=C(SC(=N4)NC(=O)CC5=CC6=C(C=C5)OCO6)C
Reference

[1]. Singh A, et al. Small Molecule Inhibitor of NRF2 Selectively Intervenes Therapeutic Resistance in KEAP1-Deficient NSCLC Tumors. ACS Chem Biol. 2016 Nov 18;11(11):3214-3225.

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