7-[2-Acetoxy-3-(4-Phenethyl-1-Piperazinyl)Propyl]-1,3-Dimethyl-7H-Purine-2,6(1H,3H)-Dione
[CAS# 19977-18-5]

Identification

• Name: 7-[2-Acetoxy-3-(4-Phenethyl-1-Piperazinyl)Propyl]-1,3-Dimethyl-7H-Purine-2,6(1H,3H)-Dione
• Synonyms: [1-[(1,3-Dimethyl-2,6-Dioxo-Purin-7-Yl)Methyl]-2-[4-(2-Phenylethyl)Piperazin-1-Yl]Ethyl] Acetate; Acetic Acid [1-[(1,3-Dimethyl-2,6-Dioxo-7-Purinyl)Methyl]-2-[4-(2-Phenylethyl)-1-Piperazinyl]Ethyl] Ester; Acetic Acid [1-[(2,6-Diketo-1,3-Dimethyl-Purin-7-Yl)Methyl]-2-[4-(2-Phenylethyl)Piperazin-1-Yl]Ethyl] Ester
• Molecular Formula: C₂₄H₃₂N₆O₄
• Molecular Weight: 468.55
• CAS Registry Number: 19977-18-5
• SMILES: C1=NC4=C([N]1CC(OC(C)=O)CN2CCN(CC2)CCC3=CC=CC=C3)C(N(C(N4C)=O)C)=O
• InChI: 1S/C24H32N6O4/c1-18(31)34-20(16-30-17-25-22-21(30)23(32)27(3)24(33)26(22)2)15-29-13-11-28(12-14-29)10-9-19-7-5-4-6-8-19/h4-8,17,20H,9-16H2,1-3H3
• InChIKey: GAAJEMZXRGGKTC-UHFFFAOYSA-N

Properties

• Density: 1.306g/cm³ (Cal.)
• Boiling point: 660.663°C at 760 mmHg (Cal.)
• Flash point: 353.356°C (Cal.)