Chloride → [4-[6-Fluoro-2-phenoxymethyl-3-(4-trifluoromethoxy-benzyl)-3H-benzoimidazol-5-yl]-piperazin-1-yl}-pyridin-4-yl-methanone

HRID 683438

Reaction equation

HRID 683438 reaction equation
[C:39]([c:40]1[cH:41][cH:42][n:43][cH:44][cH:45]1)(=[O:46])[OH:47].[Cl-:38].[Cl:48][CH2:49][Cl:50].[ClH:37].[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH2:17][c:18]3[cH:19][cH:20][c:21]([O:24][C:25]([F:26])([F:27])[F:28])[cH:22][cH:23]3)[c:7]([CH2:9][O:10][c:11]3[cH:12][cH:13][cH:14][cH:15][cH:16]3)[n:8]2)[cH:29][c:30]1[N:31]1[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]1>>[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH2:17][c:18]3[cH:19][cH:20][c:21]([O:24][C:25]([F:26])([F:27])[F:28])[cH:22][cH:23]3)[c:7]([CH2:9][O:10][c:11]3[cH:12][cH:13][cH:14][cH:15][cH:16]3)[n:8]2)[cH:29][c:30]1[N:31]1[CH2:32][CH2:33][N:34]([C:39]([c:40]2[cH:41][cH:42][n:43][cH:44][cH:45]2)=[O:46])[CH2:35][CH2:36]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 5922Isonicotinic AcidHCID 6344DichloromethaneHCID 684671025-fluoro-2-phenoxymethyl-6-piperazin-1-yl-1-(4-trifluoromethoxy-benzyl)-1H-benzoimidazole

Product 1

HCID 68463787[4-[6-Fluoro-2-phenoxymethyl-3-(4-trifluoromethoxy-benzyl)-3H-benzoimidazol-5-yl]-piperazin-1-yl}-pyridin-4-yl-methanone

Sources & evidence

ORD record
ord-31a3a76478d4493bb62659b663c0ab7c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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