1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

Base Information

• Chemical Name: 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione
• CAS No.: 939971-14-9
• Molecular Formula: C₃₃H₃₃Cl₃N₆O₆
• Molecular Weight: 716.021

Synonyms:1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

Chemical Property of 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

Chemical Property:

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Technology Process of 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

There total 2 articles about 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

1,3,5-tris-(N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione (939971-12-7) + chloroacetyl chloride (79-04-9) → 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione (939971-14-9)

Guidance literature:

In N,N-dimethyl acetamide; at 0 - 20 ℃; for 0.5h;

Reference yield:

1,3,5-tris-(N-formyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione (939971-10-5) → 1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione (939971-14-9)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride / 1,4-dioxane; water / 0.5 h / Inert atmosphere; Reflux

2: N,N-dimethyl acetamide / 0.5 h / 0 - 20 °C

With hydrogenchloride; In 1,4-dioxane; N,N-dimethyl acetamide; water;

Reference yield:

1,3,5-tris-(N-chloroacetyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione (939971-14-9) + 1,4,7-tris-tert-butoxycarbonylmethyl-1,4,7,10-tetraazacyclododecane (122555-91-3) → tert-butyl 2-(4-{[(4-{3,5-bis[2-methyl-4-(N-methyl-2-{4,7,10-tris[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl}acetamido)phenyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-3-methylphenyl)(methyl)carbamoyl]methyl}-7,10-bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl)acetate (939971-16-1)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In acetonitrile; at 75 ℃;

upstream raw materials:

1,3,5-tris-(N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

chloroacetyl chloride

1,3,5-tris-(N-formyl-N-methyl-4-amino-2-methyl-phenyl)-[1,3,5]triazinane-2,4,6-trione

Downstream raw materials:

tert-butyl 2-(4-{[(4-{3,5-bis[2-methyl-4-(N-methyl-2-{4,7,10-tris[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl}acetamido)phenyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-3-methylphenyl)(methyl)carbamoyl]methyl}-7,10-bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl)acetate

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