Sodium ion → 6-Bromo-4-[2-(4-{[(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-6-yl)methyl]amino}piperidin-1-yl)ethyl]-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

HRID 1211515Notes

Reaction equation

HRID 1211515 reaction equation
[C:35]([BH3-:36])#[N:37].[NH2:1][CH:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][N:10]2[c:11]3[c:12]([cH:17][cH:18][c:19]([Br:21])[n:20]3)[O:13][CH2:14][C:15]2=[O:16])[CH2:6][CH2:7]1.[Na+:38].[O:22]=[C:23]1[NH:24][c:25]2[c:26]([cH:29][cH:30][c:31]([CH:33]=[O:34])[n:32]2)[O:27][CH2:28]1>>[NH:1]([CH:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][N:10]2[c:11]3[c:12]([cH:17][cH:18][c:19]([Br:21])[n:20]3)[O:13][CH2:14][C:15]2=[O:16])[CH2:6][CH2:7]1)[CH2:33][c:31]1[cH:30][cH:29][c:26]2[c:25]([n:32]1)[NH:24][C:23](=[O:22])[CH2:28][O:27]2

Participants

5

Reactant 4

HCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 218737373-Oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine-6-carbaldehydeHCID 866426194-[2-(4-Aminopiperidin-1-yl)ethyl]-6-bromo-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

Product 1

HCID 159818906-Bromo-4-[2-(4-{[(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-6-yl)methyl]amino}piperidin-1-yl)ethyl]-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

Sources & evidence

ORD record
ord-d7b61f1a8087463e988523b4ca414dba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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