Tetrahydrofuran → 3-{4-[3-(1-Methyl-1H-benzoimidazol-2-yl)-phenyl]-piperazin-1-ylmethyl}-morpholine-4-carboxylic acid tert-butyl ester

HRID 2158106Notes

Reaction equation

HRID 2158106 reaction equation
[Al+3:39].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([c:22]3[cH:23][c:24](-[c:28]4[n:29][c:30]5[c:31]([n:32]4[CH3:33])[cH:34][cH:35][cH:36][cH:37]5)[cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[CH2:10][O:11][CH2:12][CH2:13]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[H-:38].[H-:41].[H-:42].[H-:43].[Li+:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:14][N:16]2[CH2:17][CH2:18][N:19]([c:22]3[cH:23][c:24](-[c:28]4[n:29][c:30]5[c:31]([n:32]4[CH3:33])[cH:34][cH:35][cH:36][cH:37]5)[cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[CH2:10][O:11][CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 686711193-{4-[3-(1-Methyl-1H-benzoimidazol-2-yl)-phenyl]-piperazine-1-carbonyl}-morpholine-4-carboxylic acid tert-butyl ester

Product 1

HCID 686701863-{4-[3-(1-Methyl-1H-benzoimidazol-2-yl)-phenyl]-piperazin-1-ylmethyl}-morpholine-4-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-f78357d224e244eab659fdd2252e3147
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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