5-((2-Methylpropyl)amino)-8-(3-(trifluoromethyl)phenyl)-3H,6H-1,4,5a,8a-tetraazaacenaphthylene-3-one

Base Information

• Chemical Name: 5-((2-Methylpropyl)amino)-8-(3-(trifluoromethyl)phenyl)-3H,6H-1,4,5a,8a-tetraazaacenaphthylene-3-one
• CAS No.: 125109-98-0
• Molecular Formula: C19H18 F3 N5 O
• UNII: PMQT6LZ3NA
• ChEMBL ID: CHEMBL136830

Synonyms:PMQT6LZ3NA;UNII-PMQT6LZ3NA;KE-748;CL-287663;5-((2-Methylpropyl)amino)-8-(3-(trifluoromethyl)phenyl)-3H,6H-1,4,5a,8a-tetraazaacenaphthylene-3-one;125109-98-0;3H,6H-1,4,5a,8a-Tetraazaacenaphthylen-3-one, 5-((2-methylpropyl)amino)-8-(3-(trifluoromethyl)phenyl)-;CHEMBL136830;SCHEMBL8520897;UXYMNHRBNKGXKO-UHFFFAOYSA-N;PD068929

Chemical Property of 5-((2-Methylpropyl)amino)-8-(3-(trifluoromethyl)phenyl)-3H,6H-1,4,5a,8a-tetraazaacenaphthylene-3-one

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 389.14634470
• Heavy Atom Count: 28
• Complexity: 690

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• Canonical SMILES: CC(C)CNC1=NC(=O)C2=C3N1CC=C(N3N=C2)C4=CC(=CC=C4)C(F)(F)F

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