methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate

Base Information

• Chemical Name: methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate
• CAS No.: 266347-97-1
• Molecular Formula: C₂₀H₂₃N₅O₈
• Molecular Weight: 461.431
• Mol file: 266347-97-1.mol

Synonyms:methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate

Chemical Property of methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate

There total 1 articles about methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate 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: 58.0%

1,3-Dicarbomethoxy-S-methylisothiourea (34840-23-8) + methyl 3-amino-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate (266348-09-8) → methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate (266347-97-1)

Guidance literature:

With acetic acid; In methanol;

DOI:10.1080/15257770008033016

Reference yield: 87.0%

methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate (266347-97-1) → [7-(ethoxycarbonyl-phenyl-amino)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]-carbamic acid methyl ester (266347-98-2)

Guidance literature:

With sodium methylate; In methanol; at 20 ℃; for 2h;

DOI:10.1080/15257770008033016

Reference yield:

methyl 3-[[[(methoxycarbonyl)amino][(methoxycarbonyl)imino]methyl]amino]-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate (266347-97-1) → 2-amino-1,5-dihydro-7-(phenylamino)-4H-pyrrolo[3,2-d]pyrimidin-4-one

Guidance literature:

Multi-step reaction with 3 steps

1: 87 percent / NaOMe / methanol / 2 h / 20 °C

2: 97 percent / NaOH / H₂O / 1 h / 50 °C

3: 75.8 percent / hydrazine hydrate / Pd(OH)2 / ethanol / 144 h / Heating

With sodium hydroxide; sodium methylate; hydrazine hydrate; palladium dihydroxide; In methanol; ethanol; water; 1: Cyclization / 2: Hydrolysis / 3: Reduction;

DOI:10.1080/15257770008033016

upstream raw materials:

1,3-Dicarbomethoxy-S-methylisothiourea

methyl 3-amino-4-[[N-(ethoxycarbonyl)-N-phenyl]amino]-1H-pyrrole-2-carboxylate

Downstream raw materials:

[7-(ethoxycarbonyl-phenyl-amino)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]-carbamic acid methyl ester

(2-amino-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-7-yl)-phenyl-carbamic acid ethyl ester