1-(2-Pyridylmethyl)-4-(P-(2-Pyrimidinylamino)Benzyl)-2,6-Piperazinedione
[CAS# 102233-14-7]

Identification

• Name: 1-(2-Pyridylmethyl)-4-(P-(2-Pyrimidinylamino)Benzyl)-2,6-Piperazinedione
• Synonyms: 1-(2-Pyridylmethyl)-4-[[4-(Pyrimidin-2-Ylamino)Phenyl]Methyl]Piperazine-2,6-Dione; 1-(2-Pyridylmethyl)-4-[[4-(2-Pyrimidinylamino)Phenyl]Methyl]Piperazine-2,6-Dione; 1-(2-Pyridylmethyl)-4-[4-(Pyrimidin-2-Ylamino)Benzyl]Piperazine-2,6-Quinone
• Molecular Formula: C₂₁H₂₀N₆O₂
• Molecular Weight: 388.43
• CAS Registry Number: 102233-14-7
• SMILES: C1=CC=NC(=N1)NC4=CC=C(CN2CC(=O)N(C(=O)C2)CC3=NC=CC=C3)C=C4
• InChI: 1S/C21H20N6O2/c28-19-14-26(15-20(29)27(19)13-18-4-1-2-9-22-18)12-16-5-7-17(8-6-16)25-21-23-10-3-11-24-21/h1-11H,12-15H2,(H,23,24,25)
• InChIKey: INHMRSKZMDRVQU-UHFFFAOYSA-N

Properties

• Density: 1.368g/cm³ (Cal.)
• Boiling point: 653.472°C at 760 mmHg (Cal.)
• Flash point: 349.008°C (Cal.)