1265829-31-9

Basic information

• Product Name: 3-(4-methylphenylthio)-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile
• CAS NO: 1265829-31-9
• Molecular Weight: 352.416
• Mol File: 1265829-31-9.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 3-(4-methylphenylthio)-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-methylphenylthio)-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile(1265829-31-9)
• EPA Substance Registry System: 3-(4-methylphenylthio)-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile(1265829-31-9)

Safety Data

• Hazardous Substances Data: 1265829-31-9(Hazardous Substances Data)

Upstream product

• 846038-96-8 8-oxo-8H-acenaphthyleno[1,2-b]pyrrole-9-carbonitrile 
• 106-45-6 para-thiocresol 

Relevant articles and documents

3-Thiomorpholin-8-oxo-8 h -acenaphtho[1,2- b ]pyrrole-9-carbonitrile (S1) based molecules as potent, dual inhibitors of B-cell lymphoma 2 (Bcl-2) and myeloid cell leukemia sequence 1 (Mcl-1): Structure-based design and structure-activity relationship studies

We recently described the discovery of a dual inhibitor of Bcl-2 and Mcl-1, 3-thiomorpholin-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile (3, S1). Here we report a structure-guided design in combination with structure-activity relationship studies to exploit the difference in the p2 binding pocket of Bcl-2 and Mcl-1, from which a novel dual inhibitor 3-(4-aminophenylthio)-8-oxo-8H- acenaphtho[1,2-b]pyrrole-9-carbonitrile (6h) was obtained, which showed significant enhanced IC50 value against Mcl-1 (5 nM), greater Mcl-1/Bak disruption potential, and accordingly a 10-fold increased cytotoxicity over 3.