4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

Base Information

Chemical Name:4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide
CAS No.:633302-81-5
Molecular Formula:C₅₆H₅₃Cl₂N₇O₈
Molecular Weight:1022.98
Hs Code.:

4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[<i>e</i>]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1<i>H</i>-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[<i>e</i>]indol-3-yl)-2-oxo-ethyl]-amide

Synonyms:4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

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Chemical Property of 4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

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Technology Process of 4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

There total 9 articles about 4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide 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: 61.0%

: N-[3-(2-aminoacetyl)-5-benzyloxy-1-chloromethyl-2,3-dihydro-1H-benzo[e]indol-7-yl]acetamide hydrochloride

: 633302-78-0
4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydrobenzo[e]indol-3-yl)-4-oxobutyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid

: 633302-81-5
4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

Guidance literature:: With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; for 12h;
DOI:10.1039/b303650m

Reference yield:

: 13138-78-8
1-methyl-4-nitro-pyrrol-2-carboxylic acid

: 633302-81-5
4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

Guidance literature:: Multi-step reaction with 5 steps

1: 82 percent / H₂SO₄ / diethyl ether / 36 h / 20 °C

2: H₂ / Pd/C / methanol / 2 h / 2585.81 Torr

3: 1.0 g / HOBt; EDCI / dimethylformamide / 12 h / 20 °C

4: 65 percent / TiCl₄ / CH₂Cl₂ / 24 h / 20 °C

5: 61 percent / HOBt; EDCI / dimethylformamide / 12 h / 20 °C

With sulfuric acid; hydrogen; titanium tetrachloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; palladium on activated charcoal; In methanol; diethyl ether; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1039/b303650m

Reference yield:

: 120122-47-6
1-methyl-4-nitro-2-trichloroacetylpyrrole

: 633302-81-5
4-[4-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-4-oxo-butyrylamino]-1-methyl-1H-pyrrole-2-carboxylic acid [2-(7-acetylamino-5-benzyloxy-1-chloromethyl-1,2-dihydro-benzo[e]indol-3-yl)-2-oxo-ethyl]-amide

Guidance literature:: Multi-step reaction with 7 steps

1: 100 percent / 80 °C

2: NaOH / tetrahydrofuran; methanol / 20 °C

3: 82 percent / H₂SO₄ / diethyl ether / 36 h / 20 °C

4: H₂ / Pd/C / methanol / 2 h / 2585.81 Torr

5: 1.0 g / HOBt; EDCI / dimethylformamide / 12 h / 20 °C

6: 65 percent / TiCl₄ / CH₂Cl₂ / 24 h / 20 °C

7: 61 percent / HOBt; EDCI / dimethylformamide / 12 h / 20 °C

With sodium hydroxide; sulfuric acid; hydrogen; titanium tetrachloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; palladium on activated charcoal; In tetrahydrofuran; methanol; diethyl ether; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1039/b303650m