2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

Base Information

Chemical Name:2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid
CAS No.:937056-56-9
Molecular Formula:C₃₃H₃₈ClN₃O₇
Molecular Weight:624.134
Hs Code.:

Synonyms:2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

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Chemical Property of 2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

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Technology Process of 2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

There total 21 articles about 2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid 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:

: 937056-55-8
ethyl 2-(1-(3-((4R,6S)-1-((acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetate

: 937056-56-9
2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

Guidance literature:: ethyl 2-(1-(3-((4R,6S)-1-((acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetate; With methanol; water; potassium carbonate; at 50 ℃; for 6h;

With water; pH=4;

Reference yield:

: 937057-48-2
[5-chloro-2-(1H-pyrrol-1-yl)phenyl](2,3-dimethoxyphenyl)methanone

: 937056-56-9
2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

Guidance literature:: Multi-step reaction with 21 steps

1.1: trichlorophosphate / 0.17 h / 0 - 20 °C

1.2: 2 h / 50 °C / Heating / reflux

1.3: 0.5 h / Heating / reflux

2.1: toluene / 100 °C

3.1: sodium tetrahydroborate / methanol / 1 h / 20 °C

4.1: trifluoroacetic acid / dichloromethane / 20 °C

5.1: Resolution of racemate

6.1: lithium aluminium tetrahydride / tetrahydrofuran / 3 h / 0 °C

6.2: 3 h / 0 °C

7.1: triethylamine / dichloromethane / 3 h / 0 °C

8.1: dimethyl sulfoxide / 13 h / 50 °C

9.1: sodium hydroxide; water; isopropyl alcohol / 96 h / Heating / reflux

9.2: 0 °C

10.1: potassium carbonate / N,N-dimethyl-formamide / 3 h / 20 °C

11.1: N,N-dimethyl-formamide / 1.33 h / -40 - 0 °C

12.1: pyridine; hydrogen; acetic acid / Raney Nickel R-100 / water / 15 h / 3800.26 Torr

13.1: sodium tetrahydroborate / tetrahydrofuran / 6 h / 20 °C

14.1: methanol; water; potassium carbonate / 3 h / 50 °C

15.1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 14 h / 20 °C

16.1: methanol; water; potassium carbonate / 16 h / 20 °C

17.1: carbon tetrabromide; triphenylphosphine / N,N-dimethyl-formamide / 1 h / 0 - 20 °C

18.1: sodium azide / N,N-dimethyl-formamide / 15 h / 20 °C

19.1: water; triphenylphosphine / tetrahydrofuran / 72 h / 20 °C

20.1: pyridine / dichloromethane / 27 h / 20 °C

21.1: methanol; water; potassium carbonate / 6 h / 50 °C

21.2: ion exchange resin IR-120B / pH 4

With pyridine; methanol; sodium hydroxide; sodium tetrahydroborate; lithium aluminium tetrahydride; sodium azide; carbon tetrabromide; water; hydrogen; potassium carbonate; benzotriazol-1-ol; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; triphenylphosphine; isopropyl alcohol; trifluoroacetic acid; trichlorophosphate; Raney Nickel R-100; In tetrahydrofuran; methanol; dichloromethane; water; dimethyl sulfoxide; N,N-dimethyl-formamide; toluene;

Reference yield:

: 937057-49-3
1-[4-chloro-2-(2,3-dimethoxybenzoyl)phenyl]-1H-pyrrole-2-carbaldehyde

: 937056-56-9
2-(1-(3-((4R,6S)-1-((Acetylamino)methyl)-8-chloro-6-(2,3-dimethoxyphenyl)-4H,6H-pyrrolo(1,2-a)(4,1)benzoxazepin-4-yl)propanoyl)-4-piperidinyl)acetic acid

Guidance literature:: Multi-step reaction with 20 steps

1.1: toluene / 100 °C

2.1: sodium tetrahydroborate / methanol / 1 h / 20 °C

3.1: trifluoroacetic acid / dichloromethane / 20 °C

4.1: Resolution of racemate

5.1: lithium aluminium tetrahydride / tetrahydrofuran / 3 h / 0 °C

5.2: 3 h / 0 °C

6.1: triethylamine / dichloromethane / 3 h / 0 °C

7.1: dimethyl sulfoxide / 13 h / 50 °C

8.1: sodium hydroxide; water; isopropyl alcohol / 96 h / Heating / reflux

8.2: 0 °C

9.1: potassium carbonate / N,N-dimethyl-formamide / 3 h / 20 °C

10.1: N,N-dimethyl-formamide / 1.33 h / -40 - 0 °C

11.1: pyridine; hydrogen; acetic acid / Raney Nickel R-100 / water / 15 h / 3800.26 Torr

12.1: sodium tetrahydroborate / tetrahydrofuran / 6 h / 20 °C

13.1: methanol; water; potassium carbonate / 3 h / 50 °C

14.1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 14 h / 20 °C

15.1: methanol; water; potassium carbonate / 16 h / 20 °C

16.1: carbon tetrabromide; triphenylphosphine / N,N-dimethyl-formamide / 1 h / 0 - 20 °C

17.1: sodium azide / N,N-dimethyl-formamide / 15 h / 20 °C

18.1: water; triphenylphosphine / tetrahydrofuran / 72 h / 20 °C

19.1: pyridine / dichloromethane / 27 h / 20 °C

20.1: methanol; water; potassium carbonate / 6 h / 50 °C

20.2: ion exchange resin IR-120B / pH 4

With pyridine; methanol; sodium hydroxide; sodium tetrahydroborate; lithium aluminium tetrahydride; sodium azide; carbon tetrabromide; water; hydrogen; potassium carbonate; benzotriazol-1-ol; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; triphenylphosphine; isopropyl alcohol; trifluoroacetic acid; Raney Nickel R-100; In tetrahydrofuran; methanol; dichloromethane; water; dimethyl sulfoxide; N,N-dimethyl-formamide; toluene;