1160521-43-6

Basic information

• Product Name: (6aR,9aS)-5,6a,7,8,9,9a-hexahydro-1-(4-acetylphenethyl)-5-methyl-3-phenylaminocyclopent[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4(1H)-one
• CAS NO: 1160521-43-6
• Molecular Weight: 468.558
• Mol File: 1160521-43-6.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: (6aR,9aS)-5,6a,7,8,9,9a-hexahydro-1-(4-acetylphenethyl)-5-methyl-3-phenylaminocyclopent[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4(1H)-one(CAS DataBase Reference)
• NIST Chemistry Reference: (6aR,9aS)-5,6a,7,8,9,9a-hexahydro-1-(4-acetylphenethyl)-5-methyl-3-phenylaminocyclopent[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4(1H)-one(1160521-43-6)
• EPA Substance Registry System: (6aR,9aS)-5,6a,7,8,9,9a-hexahydro-1-(4-acetylphenethyl)-5-methyl-3-phenylaminocyclopent[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4(1H)-one(1160521-43-6)

Safety Data

• Hazardous Substances Data: 1160521-43-6(Hazardous Substances Data)

Upstream product

• 916764-90-4 6-hydrazinyl-1-(4-methoxybenzyl)-3-methylpyrimidine-2,4(1H,3H)-dione 
• 916764-89-1 6-chloro-1-(4-methoxybenzyl)-3-methylpyrimidine-2,4(1H,3H)-dione 
• 4318-56-3 3-methyl-6-chlorouracil 
• 69614-95-5 1-(4-(2-chloroethyl)phenyl)ethan-1-one 
• 1160521-53-8 6-chloro-5-methyl-3-(phenylamino)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one 

Relevant articles and documents

Discovery of Potent and Selective Inhibitors of Phosphodiesterase 1 for the Treatment of Cognitive Impairment Associated with Neurodegenerative and Neuropsychiatric Diseases

A diverse set of 3-aminopyrazolo[3,4-d]pyrimidinones was designed and synthesized. The structure-activity relationships of these polycyclic compounds as phosphodiesterase 1 (PDE1) inhibitors were studied along with their physicochemical and pharmacokinetic properties. Systematic optimizations of this novel scaffold culminated in the identification of a clinical candidate, (6aR,9aS)-2-(4-(6-fluoropyridin-2-yl)benzyl)-5-methyl-3-(phenylamino)-5,6a,7,8,9,9a-hexahydrocyclopenta[4,5]imidazo[1,2-a]pyrazolo[4,3-e]pyrimidin-4-(2H)-one phosphate (ITI-214), which exhibited picomolar inhibitory potency for PDE1, demonstrated excellent selectivity against all other PDE families and showed good efficacy in vivo. Currently, this investigational new drug is in Phase I clinical development and being considered for the treatment of several indications including cognitive deficits associated with schizophrenia and Alzheimer's disease, movement disorders, attention deficit and hyperactivity disorders, and other central nervous system (CNS) and non-CNS disorders.