Dimethylformamide → 3-{4-[2-(2,5-Dichloro-phenoxy)-5-fluoro-pyridine-3-carbonyl]-3,4-dihydro-2H-quinoxalin-1-yl}-propionic acid ethyl ester

HRID 156956Notes

Reaction equation

HRID 156956 reaction equation
[Al+3:30].[CH2:35]([CH3:36])[O:37][C:38]([CH2:39][CH2:40][Br:41])=[O:42].[Cl:1][c:2]1[c:3]([O:4][c:5]2[n:6][cH:7][c:8]([F:23])[cH:9][c:10]2[C:11](=[O:12])[N:13]2[CH2:14][CH2:15][NH:16][c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]32)[cH:24][c:25]([Cl:28])[cH:26][cH:27]1.[H-:29].[H-:32].[H-:33].[H-:34].[Li+:31].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[n:6][cH:7][c:8]([F:23])[cH:9][c:10]2[C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([CH2:40][CH2:39][C:38]([O:37][CH2:35][CH3:36])=[O:42])[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]32)[cH:24][c:25]([Cl:28])[cH:26][cH:27]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 28486Lithium ionHCID 68320Ethyl 3-bromopropionateHCID 104727Aluminum CationHCID 166653Hydride4×HCID 59294514[2-(2,5-Dichloro-phenoxy)-5-fluoro-pyridin-3-yl]-(3,4-dihydro-2H-quinoxalin-1-yl)-methanone

Product 1

HCID 592944813-{4-[2-(2,5-Dichloro-phenoxy)-5-fluoro-pyridine-3-carbonyl]-3,4-dihydro-2H-quinoxalin-1-yl}-propionic acid ethyl ester

Sources & evidence

ORD record
ord-1424dc5cbb624512a497b9b166765723
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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