VVD-130037

• CAS: 3034880-93-5
• Catalog Number: ACM-MG-3034880935
• Category: Molecular Glues
• Molecular Weight: 344.80
• Molecular Formula: C17H17ClN4O2
• Description: VVD-130037 (BAY-3605349) is a covalent molecular glue and allosteric NRF2 degrader. VVD-130037 covalently binds to KEAP1 and allosterically enhances the affinity of KEAP1-CUL3, promotes the formation of the active KEAP1-CUL3 E3 ligase complex, and thereby enhances the ubiquitination and degradation of NRF2.
• Synonyms: BAY-3605349
• IUPAC Name: 1-[(3R)-3-[3-(4-aminopyrimidin-2-yl)-5-chlorophenyl]morpholin-4-yl]prop-2-en-1-one
• SMILES: NC1=NC(C2=CC(Cl)=CC([C@@H]3COCCN3C(C=C)=O)=C2)=NC=C1
• InChI: InChI=1S/C17H17ClN4O2/c1-2-16(23)22-5-6-24-10-14(22)11-7-12(9-13(18)8-11)17-20-4-3-15(19)21-17/h2-4,7-9,14H,1,5-6,10H2,(H2,19,20,21)/t14-/m0/s1
• InChI Key: IRLNMPCPLJZIGO-AWEZNQCLSA-N
• Appearance: White to off-white solid
• Shipping: Room temperature; may vary elsewhere.
• Storage Conditions: -20 °C, sealed storage, away from moisture and light