ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

Base Information

Chemical Name:ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate
CAS No.:1461686-03-2
Molecular Formula:C₃₄H₄₁F₃N₄O₃
Molecular Weight:610.72
Hs Code.:

ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

Synonyms:ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

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Chemical Property of ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

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Technology Process of ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

There total 6 articles about ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate 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:

: 794500-83-7
ethyl 3-(piperidin-4-yl)benzoate

: 1461686-00-9
(3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)hexahydropentalen-2(1H)-one

: 1461686-03-2
ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

Guidance literature:: ethyl 3-(piperidin-4-yl)benzoate; (3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)hexahydropentalen-2(1H)-one; With titanium(IV) isopropylate; In dichloromethane; at 20 ℃; for 12h;

With methanol; sodium tetrahydroborate; In dichloromethane; for 2h;

Reference yield:

: 611-10-9
2-ethoxycarbonyl-1-cyclopentanone

: 1461686-03-2
ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

Guidance literature:: Multi-step reaction with 6 steps

1.1: sodium hydride / N,N-dimethyl-formamide; mineral oil / 0 - 20 °C / Inert atmosphere

2.1: sodium hydride / toluene; mineral oil / 2.5 h / Reflux

3.1: hydrogen; palladium on activated charcoal / ethanol / 4 h / 20 °C / 2068.65 Torr

4.1: water; hydrogenchloride / 4 h / Reflux

5.1: triethylamine; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 12 h / 20 °C / Inert atmosphere

6.1: titanium(IV) isopropylate / dichloromethane / 12 h / 20 °C

6.2: 2 h

With titanium(IV) isopropylate; hydrogenchloride; palladium on activated charcoal; water; hydrogen; sodium hydride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In ethanol; dichloromethane; N,N-dimethyl-formamide; toluene; mineral oil;

Reference yield:

: 61771-77-5
ethyl 2-oxo-1-(2-oxopropyl)cyclopentane-1-carboxylate

: 1461686-03-2
ethyl 3-(1-((2S,3aR,6aR)-3a-((1S,4S)-5-(4-(trifluoromethyl)pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carbonyl)octahydropentalen-2-yl)piperidin-4-yl)benzoate

Guidance literature:: Multi-step reaction with 5 steps

1.1: sodium hydride / toluene; mineral oil / 2.5 h / Reflux

2.1: hydrogen; palladium on activated charcoal / ethanol / 4 h / 20 °C / 2068.65 Torr

3.1: water; hydrogenchloride / 4 h / Reflux

4.1: triethylamine; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 12 h / 20 °C / Inert atmosphere

5.1: titanium(IV) isopropylate / dichloromethane / 12 h / 20 °C

5.2: 2 h

With titanium(IV) isopropylate; hydrogenchloride; palladium on activated charcoal; water; hydrogen; sodium hydride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In ethanol; dichloromethane; toluene; mineral oil;