Hydrochloric Acid → 5-[[4-(1,3-Benzothiazol-2-yloxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide

HRID 2126380Notes

Reaction equation

HRID 2126380 reaction equation
[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:33][Si:34]([CH3:35])([CH3:36])[N:37]=[C:38]=[O:39].[CH:2]12[N:3]([CH2:9][c:10]3[cH:11][cH:12][c:13]([O:14][c:15]4[s:16][c:17]5[c:18]([n:19]4)[cH:20][cH:21][cH:22][cH:23]5)[cH:24][cH:25]3)[CH2:4][CH:5]([NH:6][CH2:7]1)[CH2:8]2.[Cl:40][CH2:41][Cl:42].[ClH:1]>>[CH:2]12[N:3]([CH2:9][c:10]3[cH:11][cH:12][c:13]([O:14][c:15]4[s:16][c:17]5[c:18]([n:19]4)[cH:20][cH:21][cH:22][cH:23]5)[cH:24][cH:25]3)[CH2:4][CH:5]([N:6]([C:38]([NH2:37])=[O:39])[CH2:7]1)[CH2:8]2

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 70696Trimethylsilyl isocyanateHCID 672071422-[4-(2,5-Diazabicyclo[2.2.1]heptan-2-ylmethyl)phenoxy]-1,3-benzothiazole

Product 1

HCID 576706125-[[4-(1,3-Benzothiazol-2-yloxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide

Sources & evidence

ORD record
ord-54e1a427a2764fa999219f8e21830f6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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