Hydrochloric Acid → 4-Fluoro-2-(4-fluorophenyl)-N-methyl-5-(2-methyl-5-(1-(pyrimidin-4-yl)-cyclopropylcarbamoyl)phenyl)benzofuran-3-carboxamide

HRID 1551924Notes

Reaction equation

HRID 1551924 reaction equation
[ClH:42].[F:1][c:2]1[c:3](-[c:22]2[cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29][c:30]2[CH3:31])[cH:4][cH:5][c:6]2[c:7]1[c:8]([C:18]([NH:19][CH3:20])=[O:21])[c:9](-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1)[o:10]2.[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:48].[n:32]1[cH:33][n:34][c:35]([C:38]2([NH2:41])[CH2:39][CH2:40]2)[cH:36][cH:37]1>>[F:1][c:2]1[c:3](-[c:22]2[cH:23][c:24]([C:25](=[O:27])[NH:41][C:38]3([c:35]4[n:34][cH:33][n:32][cH:37][cH:36]4)[CH2:39][CH2:40]3)[cH:28][cH:29][c:30]2[CH3:31])[cH:4][cH:5][c:6]2[c:7]1[c:8]([C:18]([NH:19][CH3:20])=[O:21])[c:9](-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1)[o:10]2

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 592756803-(4-Fluoro-2-(4-fluorophenyl)-3-(methylcarbamoyl)benzofuran-5-yl)-4-methylbenzoic acidHCID 639879361-(Pyrimidin-4-yl)cyclopropanamine

Product 1

HCID 534682484-Fluoro-2-(4-fluorophenyl)-N-methyl-5-(2-methyl-5-(1-(pyrimidin-4-yl)-cyclopropylcarbamoyl)phenyl)benzofuran-3-carboxamide

Sources & evidence

ORD record
ord-9e7dc1d9071340ab89a228cf4d776d72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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