Water → Tert-butyl 4-[3-(2-chloro-4-nitroimidazol-1-yl)-2-hydroxy-2-methylpropyl]piperazine-1-carboxylate

HRID 1238161Notes

Reaction equation

HRID 1238161 reaction equation
[Cl:1][c:2]1[n:3]([CH2:10][C:11]2([CH3:14])[O:12][CH2:13]2)[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1.[N:15]1([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[O:28]=[CH:29][N:30]([CH3:31])[CH3:32].[OH2:33]>>[Cl:1][c:2]1[n:3]([CH2:10][C:11]([OH:12])([CH2:13][N:18]2[CH2:17][CH2:16][N:15]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:20][CH2:19]2)[CH3:14])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 143452tert-Butyl piperazine-1-carboxylateHCID 159655232-Chloro-1-(2-methyloxiran-2-ylmethyl)-4-nitroimidazole

Product 1

HCID 69481160Tert-butyl 4-[3-(2-chloro-4-nitroimidazol-1-yl)-2-hydroxy-2-methylpropyl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-8aaa481054ca4c8f9a30890630eb63ae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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