8-(Benzylamino)-7-[3-(4-Benzylpiperazin-1-Yl)-2-Hydroxypropyl]-1,3-Dimethylpurine-2,6-Dione Dihydrochloride
[CAS# 105319-52-6]

Identification

• Name: 8-(Benzylamino)-7-[3-(4-Benzylpiperazin-1-Yl)-2-Hydroxypropyl]-1,3-Dimethylpurine-2,6-Dione Dihydrochloride
• Synonyms: 8-(Benzylamino)-7-[3-(4-Benzylpiperazin-1-Yl)-2-Hydroxy-Propyl]-1,3-Dimethyl-Purine-2,6-Dione Dihydrochloride; 8-(Benzylamino)-7-[3-(4-Benzyl-1-Piperazinyl)-2-Hydroxypropyl]-1,3-Dimethylpurine-2,6-Dione Dihydrochloride; 8-(Benzylamino)-7-[3-(4-Benzylpiperazin-1-Yl)-2-Hydroxy-Propyl]-1,3-Dimethyl-Xanthine Dihydrochloride
• Molecular Formula: C₂₈H₃₇Cl₂N₇O₃
• Molecular Weight: 590.55
• CAS Registry Number: 105319-52-6
• SMILES: [H+].[H+].C(N1CCN(CC1)CC2=CC=CC=C2)C(O)C[N]3C5=C(N=C3NCC4=CC=CC=C4)N(C(=O)N(C5=O)C)C.[Cl-].[Cl-]
• InChI: 1S/C28H35N7O3.2ClH/c1-31-25-24(26(37)32(2)28(31)38)35(27(30-25)29-17-21-9-5-3-6-10-21)20-23(36)19-34-15-13-33(14-16-34)18-22-11-7-4-8-12-22;;/h3-12,23,36H,13-20H2,1-2H3,(H,29,30);2*1H
• InChIKey: VOWBYAMVXOXXAK-UHFFFAOYSA-N

Properties

• Boiling point: 732.7°C at 760 mmHg (Cal.)
• Flash point: 396.9°C (Cal.)