C₃₁H₃₃Cl₂N₇O₄

Base Information

• Chemical Name: C₃₁H₃₃Cl₂N₇O₄
• CAS No.: 89848-12-4
• Molecular Formula: C₃₁H₃₃Cl₂N₇O₄
• Molecular Weight: 638.554
• Mol file: 89848-12-4.mol

Synonyms:C₃₁H₃₃Cl₂N₇O₄

Chemical Property of C₃₁H₃₃Cl₂N₇O₄

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of C₃₁H₃₃Cl₂N₇O₄

There total 7 articles about C₃₁H₃₃Cl₂N₇O₄ 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: 98.0%

[4-(4-{4-[(2R,4S)-2-(2,4-Dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-carbamic acid phenyl ester (89848-10-2) → C31H33Cl2N7O4 (89848-12-4)

Guidance literature:

With hydrazine hydrate; In 1,4-dioxane; for 3h; Heating;

DOI:10.1021/jm00373a015

Reference yield:

cis-[2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)methyl-(1,3-dioxolan-4-yl)]methyl methanesulfonate (61397-61-3) → C31H33Cl2N7O4 (89848-12-4)

Guidance literature:

Multi-step reaction with 6 steps

1: 1.) NaH / 1.) Me₂SO, 1 h, 2.) Me₂SO, 80 deg C, 5 h

2: 71 percent / NaOH / butan-1-ol / Heating

3: 54 percent / K₂CO₃ / dimethylsulfoxide / 120 °C

4: 97 percent / H₂, thiophene / 5percent Pd/C / 2-methoxy-ethanol; methanol / 50 °C / Heating

5: 82 percent / pyridine / CHCl₃ / 3 h

6: 98 percent / hydrazine hydrate / dioxane / 3 h / Heating

With thiophene; pyridine; sodium hydroxide; hydrogen; sodium hydride; potassium carbonate; hydrazine hydrate; palladium on activated charcoal; In 1,4-dioxane; methanol; chloroform; 2-methoxy-ethanol; dimethyl sulfoxide; butan-1-ol;

DOI:10.1021/jm00373a015

Reference yield:

ketoconazole (65277-42-1) → C31H33Cl2N7O4 (89848-12-4)

Guidance literature:

Multi-step reaction with 5 steps

1: 71 percent / NaOH / butan-1-ol / Heating

2: 54 percent / K₂CO₃ / dimethylsulfoxide / 120 °C

3: 97 percent / H₂, thiophene / 5percent Pd/C / 2-methoxy-ethanol; methanol / 50 °C / Heating

4: 82 percent / pyridine / CHCl₃ / 3 h

5: 98 percent / hydrazine hydrate / dioxane / 3 h / Heating

With thiophene; pyridine; sodium hydroxide; hydrogen; potassium carbonate; hydrazine hydrate; palladium on activated charcoal; In 1,4-dioxane; methanol; chloroform; 2-methoxy-ethanol; dimethyl sulfoxide; butan-1-ol;

DOI:10.1021/jm00373a015

upstream raw materials:

[4-(4-{4-[(2R,4S)-2-(2,4-Dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-carbamic acid phenyl ester

cis-[2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)methyl-(1,3-dioxolan-4-yl)]methyl methanesulfonate

4-<4-<-1,3-dioxolan-4-yl>methylenoxy>phenyl>piperazine

ketoconazole

Downstream raw materials:

4-[4-(4-{4-[(2R,4S)-2-(2,4-Dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-2-isopropyl-2,4-dihydro-[1,2,4]triazol-3-one

2-Allyl-4-[4-(4-{4-[(2R,4S)-2-(2,4-dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-2,4-dihydro-[1,2,4]triazol-3-one

4-[4-(4-{4-[(2R,4S)-2-(2,4-Dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-2-isopropyl-5-methyl-2,4-dihydro-[1,2,4]triazol-3-one

2-Butyl-4-[4-(4-{4-[(2R,4S)-2-(2,4-dichloro-phenyl)-2-imidazol-1-ylmethyl-[1,3]dioxolan-4-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-2,4-dihydro-[1,2,4]triazol-3-one

Refernces