2-Methyl-7-Propyl-6-[[2'-(2H-Tetrazol-5-Yl)[1,1'-Biphenyl]-4-Yl]Methyl]-[1,2,4]Triazolo[1,5-a]Pyrimidin-5(1H)-One
[CAS# 168152-73-6]

Identification

• Name: 2-Methyl-7-Propyl-6-[[2'-(2H-Tetrazol-5-Yl)[1,1'-Biphenyl]-4-Yl]Methyl]-[1,2,4]Triazolo[1,5-a]Pyrimidin-5(1H)-One
• Synonyms: 2-Methyl-7-Propyl-6-[[4-[2-(2H-1,2,3,4-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]-1H-[1,2,4]Triazolo[1,5-A]Pyrimidin-5-One; (1,2,4)Triazolo(1,5-A)Pyrimidin-5(1H)-One, 2-Methyl-7-Propyl-6-((2'-(1H-Tetrazol-5-Yl)(1,1'-Biphenyl)-4-Yl)Methyl)-; 2-Methyl-7-Propyl-6-[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Benzyl]-1H-[1,2,4]Triazolo[1,5-A]Pyrimidin-5-One
• Molecular Formula: C₂₃H₂₂N₈O
• Molecular Weight: 426.48
• CAS Registry Number: 168152-73-6
• SMILES: C3=C(CC2=C(N1NC(=NC1=NC2=O)C)CCC)C=CC(=C3)C4=CC=CC=C4C5=N[NH]N=N5
• InChI: 1S/C23H22N8O/c1-3-6-20-19(22(32)25-23-24-14(2)28-31(20)23)13-15-9-11-16(12-10-15)17-7-4-5-8-18(17)21-26-29-30-27-21/h4-5,7-12H,3,6,13H2,1-2H3,(H,24,25,28,32)(H,26,27,29,30)
• InChIKey: NCCKPPZZRARSHM-UHFFFAOYSA-N

Properties

• Density: 1.425g/cm³ (Cal.)
• Boiling point: 649.614°C at 760 mmHg (Cal.)
• Flash point: 346.674°C (Cal.)