5-Butyl-6-[[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]-1H-Pyrazolo[5,1-b]Pyrimidin-7-One
[CAS# 167375-24-8]

Identification

• Name: 5-Butyl-6-[[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]-1H-Pyrazolo[5,1-b]Pyrimidin-7-One
• Synonyms: 5-Butyl-6-[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Benzyl]-1H-Pyrazolo[5,1-B]Pyrimidin-7-One; 5-Butyl-6-[[4-[2-(2H-1,2,3,4-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]-1H-Pyrazolo[5,1-B]Pyrimidin-7-One; Pyrazolo(1,5-A)Pyrimidin-7-Ol, 5-Butyl-6-((2'-(1H-Tetrazol-5-Yl)(1,1'-Biphenyl)-4-Yl)Methyl)-
• Molecular Formula: C₂₄H₂₃N₇O
• Molecular Weight: 425.49
• CAS Registry Number: 167375-24-8
• SMILES: C3=C(CC2=C(N=C1N(NC=C1)C2=O)CCCC)C=CC(=C3)C4=CC=CC=C4C5=N[NH]N=N5
• InChI: 1S/C24H23N7O/c1-2-3-8-21-20(24(32)31-22(26-21)13-14-25-31)15-16-9-11-17(12-10-16)18-6-4-5-7-19(18)23-27-29-30-28-23/h4-7,9-14,25H,2-3,8,15H2,1H3,(H,27,28,29,30)
• InChIKey: VWIFTEHIYUHYQI-UHFFFAOYSA-N

Properties

• Density: 1.366g/cm³ (Cal.)
• Boiling point: 662.583°C at 760 mmHg (Cal.)
• Flash point: 354.518°C (Cal.)