Lithium ion → 4-(4-Ethoxyphenyl)-N-(2-methoxyethyl)-N-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-1-(phenylmethyl)-2-piperazinemethanamine

HRID 1113580Notes

Reaction equation

HRID 1113580 reaction equation
[Al+3:43].[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH:12]([C:23](=[O:24])[N:25]([c:26]3[cH:27][cH:28][c:29](-[n:32]4[c:33]([CH3:37])[n:34][cH:35][cH:36]4)[cH:30][cH:31]3)[CH2:38][CH2:39][O:40][CH3:41])[N:13]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1.[H-:42].[H-:45].[H-:46].[H-:47].[Li+:44]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH:12]([CH2:23][N:25]([c:26]3[cH:27][cH:28][c:29](-[n:32]4[c:33]([CH3:37])[n:34][cH:35][cH:36]4)[cH:30][cH:31]3)[CH2:38][CH2:39][O:40][CH3:41])[N:13]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1

Participants

5

Reactant 4

HCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 149987784-(4-Ethoxyphenyl)-N-(2-methoxyethyl)-N-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-1-(phenylmethyl)-2-piperazinecarboxamide

Product 1

HCID 149987794-(4-Ethoxyphenyl)-N-(2-methoxyethyl)-N-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-1-(phenylmethyl)-2-piperazinemethanamine

Sources & evidence

ORD record
ord-818b8550e02b4493bcaec71149777dad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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