6-[4-(1,3-Benzodioxol-5-Ylmethyl)Piperazin-1-Yl]-9-(2-Methoxyphenyl)Purine
[CAS# 37425-32-4]

Identification

• Name: 6-[4-(1,3-Benzodioxol-5-Ylmethyl)Piperazin-1-Yl]-9-(2-Methoxyphenyl)Purine
• Synonyms: 6-[4-(1,3-Benzodioxol-5-Ylmethyl)-1-Piperazinyl]-9-(2-Methoxyphenyl)Purine; 6-(4-(3,4-Methylenedioxybenzyl)-1-Piperazinyl)-9-(O-Methoxyphenyl)-9H-Purine; 9H-Purine, 9-(O-Methoxyphenyl)-6-(4-Piperonyl-1-Piperazinyl)-
• Molecular Formula: C₂₄H₂₄N₆O₃
• Molecular Weight: 444.49
• CAS Registry Number: 37425-32-4
• SMILES: C1=NC3=C([N]1C2=CC=CC=C2OC)N=CN=C3N4CCN(CC4)CC6=CC=C5OCOC5=C6
• InChI: 1S/C24H24N6O3/c1-31-19-5-3-2-4-18(19)30-15-27-22-23(25-14-26-24(22)30)29-10-8-28(9-11-29)13-17-6-7-20-21(12-17)33-16-32-20/h2-7,12,14-15H,8-11,13,16H2,1H3
• InChIKey: UOAQKWOXMVOBEN-UHFFFAOYSA-N

Properties

• Density: 1.422g/cm³ (Cal.)
• Boiling point: 650.829°C at 760 mmHg (Cal.)
• Flash point: 347.409°C (Cal.)