Hydrogen Bromide → 2-[4-(4-Methyl-3'-nitro-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-6'-yl)-piperazin-1-yl]-1-morpholin-4-yl-ethanone

HRID 1571273Notes

Reaction equation

HRID 1571273 reaction equation
[BrH:1].[BrH:2].[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:3][CH:4]1[CH2:5][CH2:6][N:7]([c:10]2[n:11][c:12]([N:19]3[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]3)[cH:13][cH:14][c:15]2[N+:16](=[O:17])[O-:18])[CH2:8][CH2:9]1.[Cl:32][CH2:33][C:34](=[O:35])[N:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[Cl:42][CH2:43][Cl:44]>>[CH3:3][CH:4]1[CH2:5][CH2:6][N:7]([c:10]2[n:11][c:12]([N:19]3[CH2:20][CH2:21][N:22]([CH2:33][C:34](=[O:35])[N:36]4[CH2:37][CH2:38][O:39][CH2:40][CH2:41]4)[CH2:23][CH2:24]3)[cH:13][cH:14][c:15]2[N+:16](=[O:17])[O-:18])[CH2:8][CH2:9]1

Participants

6

Reactant 5

HCID 260Hydrogen Bromide2×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 74040Morpholine, 4-(chloroacetyl)-HCID 586385081-[6-(4-Methylpiperidin-1-yl)-5-nitro-2-pyridinyl]piperazine

Product 1

HCID 586385422-[4-(4-Methyl-3'-nitro-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-6'-yl)-piperazin-1-yl]-1-morpholin-4-yl-ethanone

Sources & evidence

ORD record
ord-44541d2af46944bb826bd831a1d7f53b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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