2-Bromo-N-[4-[4-[(2,4-Diaminopyrimidin-5-Yl)Methyl]-2,6-Dimethoxyphenoxy]Phenyl]Acetamide Hydrobromide
[CAS# 78025-83-9]

Identification

• Name: 2-Bromo-N-[4-[4-[(2,4-Diaminopyrimidin-5-Yl)Methyl]-2,6-Dimethoxyphenoxy]Phenyl]Acetamide Hydrobromide
• Synonyms: 2-Bromo-N-[4-[4-[(2,4-Diaminopyrimidin-5-Yl)Methyl]-2,6-Dimethoxy-Phenoxy]Phenyl]Acetamide Hydrobromide; 2-Bromo-N-[4-[4-[(2,4-Diamino-5-Pyrimidinyl)Methyl]-2,6-Dimethoxyphenoxy]Phenyl]Acetamide Hydrobromide; 2-Bromo-N-[4-[4-[(2,4-Diaminopyrimidin-5-Yl)Methyl]-2,6-Dimethoxy-Phenoxy]Phenyl]Ethanamide Hydrobromide
• Molecular Formula: C₂₁H₂₃Br₂N₅O₄
• Molecular Weight: 569.25
• CAS Registry Number: 78025-83-9
• SMILES: [H+].C2=C(CC1=CN=C(N=C1N)N)C=C(OC)C(=C2OC)OC3=CC=C(NC(=O)CBr)C=C3.[Br-]
• InChI: 1S/C21H22BrN5O4.BrH/c1-29-16-8-12(7-13-11-25-21(24)27-20(13)23)9-17(30-2)19(16)31-15-5-3-14(4-6-15)26-18(28)10-22;/h3-6,8-9,11H,7,10H2,1-2H3,(H,26,28)(H4,23,24,25,27);1H
• InChIKey: LSKHELMGYVZMCN-UHFFFAOYSA-N

Properties

• Boiling point: 753.3°C at 760 mmHg (Cal.)
• Flash point: 409.4°C (Cal.)