2-(2-(4-(2-Methoxyphenyl)-1-piperazinyl)ethyl)amino-5-acetyl-4,6-dimethylpyrimidine trihydrochloride
[CAS# 121264-02-6]

Identification

• Name: 2-(2-(4-(2-Methoxyphenyl)-1-piperazinyl)ethyl)amino-5-acetyl-4,6-dimethylpyrimidine trihydrochloride
• Synonyms: 1-[2-[2-[4-(2-Methoxyphenyl)Piperazin-1-Yl]Ethylamino]-4,6-Dimethyl-Pyrimidin-5-Yl]Ethanone Trihydrochloride; 1-[2-[2-[4-(2-Methoxyphenyl)-1-Piperazinyl]Ethylamino]-4,6-Dimethyl-5-Pyrimidinyl]Ethanone Trihydrochloride; Shi 437
• Molecular Formula: C₂₁H₃₂Cl₃N₅O₂
• Molecular Weight: 492.88
• CAS Registry Number: 121264-02-6
• SMILES: N1=C(C(=C(N=C1NCCN3CCN(C2=CC=CC=C2OC)CC3)C)C(=O)C)C.[H+].[H+].[H+].[Cl-].[Cl-].[Cl-]
• InChI: 1S/C21H29N5O2.3ClH/c1-15-20(17(3)27)16(2)24-21(23-15)22-9-10-25-11-13-26(14-12-25)18-7-5-6-8-19(18)28-4;;;/h5-8H,9-14H2,1-4H3,(H,22,23,24);3*1H
• InChIKey: GZYRDLQDXVNZIO-UHFFFAOYSA-N

Properties

• Boiling point: 580.8°C at 760 mmHg (Cal.)
• Flash point: 305.1°C (Cal.)