Tetrahydrofuran → Tert-butyl 4-(3-(2-fluoronicotinoyl)isoquinolin-1-yl)-1,4-diazepane-1-carboxylate

HRID 2317559Notes

Reaction equation

HRID 2317559 reaction equation
[Br:6][c:7]1[n:8][c:9]([N:17]2[CH2:18][CH2:19][N:20]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:21][CH2:22][CH2:23]2)[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[cH:16]1.[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[F:31][c:32]1[c:33]([C:34](=[O:35])[N:36]([O:37][CH3:38])[CH3:39])[cH:40][cH:41][cH:42][n:43]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[c:7]1([C:34]([c:33]2[c:32]([F:31])[n:43][cH:42][cH:41][cH:40]2)=[O:35])[n:8][c:9]([N:17]2[CH2:18][CH2:19][N:20]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:21][CH2:22][CH2:23]2)[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[cH:16]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 534170672-Fluoro-N-methoxy-N-methylnicotinamideHCID 57690659Tert-butyl 4-(3-bromoisoquinolin-1-yl)-1,4-diazepane-1-carboxylateHCID 178418339Butyllithium

Product 1

HCID 57690632Tert-butyl 4-(3-(2-fluoronicotinoyl)isoquinolin-1-yl)-1,4-diazepane-1-carboxylate

Sources & evidence

ORD record
ord-7dae49ff52904e51b928db1cd17d9d76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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