(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

Base Information

Chemical Name:(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide
CAS No.:1351764-50-5
Molecular Formula:C₃₆H₂₉Cl₂FN₆O₅
Molecular Weight:715.568
Hs Code.:

(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

Synonyms:(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

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Chemical Property of (S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

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Technology Process of (S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

There total 16 articles about (S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide 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:

: 1351281-46-3
(S)-3-amino-5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-1H-benzo[e][1,4]diazepin-2(3H)-one

: 1351763-42-2
5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinic acid

: 1351764-50-5
(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

Guidance literature:: 5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinic acid; With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; triethylamine; In dichloromethane; for 0.0833333h;

(S)-3-amino-5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-1H-benzo[e][1,4]diazepin-2(3H)-one; In dichloromethane; for 3h;

Reference yield:

: 591-35-5
3,5-dichlorophenol

: 1351764-50-5
(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

Guidance literature:: Multi-step reaction with 8 steps

1.1: sodium hydride / toluene; mineral oil / 2.25 h / 0 - 10 °C / Industry scale; Inert atmosphere

1.2: 2 h / 10 °C

2.1: potassium carbonate; sodium hydroxide / N,N-dimethyl-formamide; ethanol / 50 °C / Industry scale; Inert atmosphere

2.2: 1 h / 50 - 55 °C

3.1: triethylamine / palladium diacetate; CataCXiumPOMeCy / 1,4-dioxane / 1 h / 10 °C / Inert atmosphere; Industry scale

3.2: 5 h / 80 °C / Inert atmosphere

4.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane / 3 h / 80 °C / Inert atmosphere

5.1: hydrogenchloride / 1,4-dioxane / 12 h / 18 - 23 °C / Industry scale; Inert atmosphere

6.1: sodium hydrogencarbonate / dichloromethane

7.1: 3,5-dichlorosalicyclaldehyde; O,O'-dibenzoyl-L-tartaric acid / Isopropyl acetate / 3 h / 20 - 70 °C

8.1: triethylamine; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate / dichloromethane / 0.08 h

8.2: 3 h

With hydrogenchloride; sodium hydride; sodium hydrogencarbonate; sodium carbonate; potassium carbonate; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; triethylamine; O,O'-dibenzoyl-L-tartaric acid; sodium hydroxide; 3,5-dichlorosalicyclaldehyde; tetrakis(triphenylphosphine) palladium⁽⁰⁾; CataCXiumPOMeCy; palladium diacetate; In 1,4-dioxane; 1,2-dimethoxyethane; ethanol; dichloromethane; Isopropyl acetate; N,N-dimethyl-formamide; toluene; mineral oil;

Reference yield:

: 16512-74-6
1-(4-methoxybenzyl)-2H-benzo[d][1,3]oxazine-2,4(1H)-dione

: 1351764-50-5
(S)-N-(5-(2,4-dichloro-6-ethoxyphenyl)-1-(4-methoxybenzyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-5-fluoro-2-(pyrimidin-2-ylmethoxy)nicotinamide

Guidance literature:: Multi-step reaction with 9 steps

1.1: acetic acid / 24 h / 92 °C / Industry scale; Inert atmosphere

2.1: N,N-dimethyl-aniline; phosphorus trichloride / toluene / 16 h / 110 °C / Industry scale; Inert atmosphere

2.2: 25 °C / pH > 12

3.1: 2,4,6-Triisopropylbenzenesulfonyl azide; potassium tert-butylate / 2-methyltetrahydrofuran / 2.5 h / 40 - 50 °C / Inert atmosphere; 3 ? molecular sieve

3.2: 36 h / -20 - 30 °C / pH > 12

4.1: hydrogen / platinum(IV) oxide / 1,4-dioxane / 3 h / 7500.75 Torr / Industry scale; Autoclave

5.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane / 3 h / 80 °C / Inert atmosphere

6.1: hydrogenchloride / 1,4-dioxane / 12 h / 18 - 23 °C / Industry scale; Inert atmosphere

7.1: sodium hydrogencarbonate / dichloromethane

8.1: 3,5-dichlorosalicyclaldehyde; O,O'-dibenzoyl-L-tartaric acid / Isopropyl acetate / 3 h / 20 - 70 °C

9.1: triethylamine; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate / dichloromethane / 0.08 h

9.2: 3 h

With hydrogenchloride; 2,4,6-Triisopropylbenzenesulfonyl azide; potassium tert-butylate; hydrogen; sodium hydrogencarbonate; sodium carbonate; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; acetic acid; N,N-dimethyl-aniline; triethylamine; O,O'-dibenzoyl-L-tartaric acid; phosphorus trichloride; 3,5-dichlorosalicyclaldehyde; platinum(IV) oxide; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 2-methyltetrahydrofuran; 1,4-dioxane; 1,2-dimethoxyethane; dichloromethane; Isopropyl acetate; toluene;