methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

Base Information

Chemical Name:methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate
CAS No.:1516886-04-6
Molecular Formula:C₂₉H₃₉N₃O₄S
Molecular Weight:525.712
Hs Code.:

methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

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Chemical Property of methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

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Technology Process of methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

There total 10 articles about methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate 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:

: 1608485-27-3
C₂₆H₃₄N₂O₅S₂

: 3196-73-4
methyl 3-aminopropanoate hydrochloride

: 1516886-04-6
methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

Guidance literature:: methyl 3-aminopropanoate hydrochloride; In acetonitrile;

C₂₆H₃₄N₂O₅S₂; With triethylamine; In acetonitrile; at 80 ℃; for 96h; Sealed tube;
DOI:10.1021/jm401456d

Reference yield:

: 1073-13-8
4,4-dimethylcyclohexenone

: 1516886-04-6
methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

Guidance literature:: Multi-step reaction with 10 steps

1.1: hydrogen; palladium 10% on activated carbon / ethyl acetate / 2 h / 20 °C / 750.08 Torr

2.1: potassium tert-butylate / tetrahydrofuran; tert-butyl alcohol / 0.5 h / 20 °C / Cooling with ice

2.2: 0.83 h / 15 - 20 °C

3.1: oxalyl dichloride / chloroform / 1 h / 20 - 25 °C

4.1: sodium; ethanol / tetrahydrofuran / 1 h / 20 °C

5.1: sodium; ethanol / 0.25 h / 50 - 75 °C

6.1: water; lithium hydroxide / ethanol / 70 °C

7.1: O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C

7.2: 18 h / 20 °C

8.1: sodium hydroxide / isopropyl alcohol; water / 66 h / 65 °C

9.1: triethylamine / dichloromethane / 3 h / 0 - 20 °C

10.1: Dowex marathon ion exchange resin / acetonitrile

10.2: 96 h / 80 °C / Sealed tube

With oxalyl dichloride; ethanol; palladium 10% on activated carbon; potassium tert-butylate; water; hydrogen; sodium; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; triethylamine; N-ethyl-N,N-diisopropylamine; sodium hydroxide; lithium hydroxide; In tetrahydrofuran; ethanol; dichloromethane; chloroform; water; ethyl acetate; N,N-dimethyl-formamide; isopropyl alcohol; acetonitrile; tert-butyl alcohol;
DOI:10.1021/jm401456d

Reference yield:

: C₁₃H₂₀O₃S

: 1516886-04-6
methyl 3-((2-(2-ethyl-4-(5-(3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydrobenzo[c]thiophen-1-yl)-1,2,4-oxadiazol-3-yl)-6-methylphenoxy)ethyl)amino)propanoate

Guidance literature:: Multi-step reaction with 6 steps

1.1: sodium; ethanol / 0.25 h / 50 - 75 °C

2.1: water; lithium hydroxide / ethanol / 70 °C

3.1: O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C

3.2: 18 h / 20 °C

4.1: sodium hydroxide / isopropyl alcohol; water / 66 h / 65 °C

5.1: triethylamine / dichloromethane / 3 h / 0 - 20 °C

6.1: Dowex marathon ion exchange resin / acetonitrile

6.2: 96 h / 80 °C / Sealed tube

With ethanol; water; sodium; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; triethylamine; N-ethyl-N,N-diisopropylamine; sodium hydroxide; lithium hydroxide; In ethanol; dichloromethane; water; N,N-dimethyl-formamide; isopropyl alcohol; acetonitrile;
DOI:10.1021/jm401456d