1,4-Dioxane → HCID 68817460, compound

HRID 1541167Notes

Reaction equation

HRID 1541167 reaction equation
[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][C:36](=[O:37])[N:38]1[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]1.[CH2:44]1[O:45][CH2:46][CH2:47][O:48][CH2:49]1.[Cl:1][c:2]1[cH:3][c:4]([NH:24][c:25]2[n:26][nH:27][c:28]([CH3:30])[cH:29]2)[n:5][c:6]([N:8]2[CH:9]([c:13]3[cH:14][c:15](-[c:18]4[n:19][cH:20][cH:21][cH:22][cH:23]4)[n:16][o:17]3)[CH2:10][CH2:11][CH2:12]2)[n:7]1>>[c:2]1([N:41]2[CH2:40][CH2:39][N:38]([C:36]([O:35][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:37])[CH2:43][CH2:42]2)[cH:3][c:4]([NH:24][c:25]2[n:26][nH:27][c:28]([CH3:30])[cH:29]2)[n:5][c:6]([N:8]2[CH:9]([c:13]3[cH:14][c:15](-[c:18]4[n:19][cH:20][cH:21][cH:22][cH:23]4)[n:16][o:17]3)[CH2:10][CH2:11][CH2:12]2)[n:7]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 143452tert-Butyl piperazine-1-carboxylateHCID 11281654HCID 11281654, compound

Product 1

HCID 68817460HCID 68817460, compound

Sources & evidence

ORD record
ord-7000df71fae14707a06c42010f5b405b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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