Dimethylformamide → (RS)-1-[2-(5,6-Difluoro-1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

HRID 2338373Notes

Reaction equation

HRID 2338373 reaction equation
[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:14](=[O:15])[OH:16])[n:10][c:11]([CH3:13])[s:12]2)[cH:6][cH:7]1.[F:50][c:51]1[cH:52][c:53]2[c:54]([nH:55][c:56]([CH2:58][CH:59]3[NH:60][CH2:61][CH2:62][CH2:63][CH2:64]3)[n:57]2)[cH:65][c:66]1[F:67].[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[n:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:14](=[O:16])[N:60]3[CH:59]([CH2:58][c:56]4[nH:55][c:54]5[c:53]([cH:52][c:51]([F:50])[c:66]([F:67])[cH:65]5)[n:57]4)[CH2:64][CH2:63][CH2:62][CH2:61]3)[n:10][c:11]([CH3:13])[s:12]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 17973671HCID 17973671, compoundHCID 223241255-(4-Fluorophenyl)-2-methyl-1,3-thiazole-4-carboxylic acid

Product 1

HCID 17973672(RS)-1-[2-(5,6-Difluoro-1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

Sources & evidence

ORD record
ord-4c6bc7cc9aee44af8635ec70a8fc6e45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…