1-[7-(4-Methoxyphenyl)-5-Phenyl-1,7-Dihydro-[1,2,4]Triazolo[1,5-a]Pyrimidin-2-Yl]Pyrrolidine-2,5-Dione
[CAS# 171668-02-3]

Identification

• Name: 1-[7-(4-Methoxyphenyl)-5-Phenyl-1,7-Dihydro-[1,2,4]Triazolo[1,5-a]Pyrimidin-2-Yl]Pyrrolidine-2,5-Dione
• Synonyms: 1-[7-(4-Methoxyphenyl)-5-Phenyl-1,7-Dihydro-[1,2,4]Triazolo[1,5-A]Pyrimidin-2-Yl]Pyrrolidine-2,5-Quinone; Stock3s-77233; 2,5-Pyrrolidinedione, 1-(7-(4-Methoxyphenyl)-5-Phenyl-4,7-Dihydro-(1,2,4)Triazolo(1,5-A)Pyrimidin-2-Yl)-
• Molecular Formula: C₂₂H₁₉N₅O₃
• Molecular Weight: 401.42
• CAS Registry Number: 171668-02-3
• SMILES: C5=C(C2N1NC(=NC1=NC(=C2)C3=CC=CC=C3)N4C(=O)CCC4=O)C=CC(=C5)OC
• InChI: 1S/C22H19N5O3/c1-30-16-9-7-15(8-10-16)18-13-17(14-5-3-2-4-6-14)23-21-24-22(25-27(18)21)26-19(28)11-12-20(26)29/h2-10,13,18H,11-12H2,1H3,(H,23,24,25)
• InChIKey: RUQQIQBYRSXSKH-UHFFFAOYSA-N

Properties

• Density: 1.434g/cm³ (Cal.)
• Boiling point: 580.002°C at 760 mmHg (Cal.)
• Flash point: 304.574°C (Cal.)