Potassium Cation → Tert-butyl 4-(3-bromoisoquinolin-1-yl)-1,4-diazepane-1-carboxylate

HRID 151515Notes

Reaction equation

HRID 151515 reaction equation
[Br:1][c:2]1[n:3][c:4]([Br:12])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[cH:11]1.[C:27](=[O:28])([O-:29])[O-:30].[K+:31].[K+:32].[N:13]1([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:14][CH2:15][NH:16][CH2:17][CH2:18][CH2:19]1.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37]>>[Br:1][c:2]1[n:3][c:4]([N:16]2[CH2:15][CH2:14][N:13]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:19][CH2:18][CH2:17]2)[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[cH:11]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 6409761,3-DibromoisoquinolineHCID 2756058Tert-butyl 1,4-diazepane-1-carboxylate

Product 1

HCID 57690659Tert-butyl 4-(3-bromoisoquinolin-1-yl)-1,4-diazepane-1-carboxylate

Sources & evidence

ORD record
ord-f6e09d524ae04eb783774f6964dfd137
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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