Water → 1-[4-Hydroxy-4-(3-(trifluoromethyl)phenyl)-1-piperidinyl]-2-(6-benzimidazolyl)-1-ethanone

HRID 700806

Reaction equation

HRID 700806 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[OH2:49].[OH:14][C:15]1([c:21]2[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]2)[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[nH:1]1[cH:2][n:3][c:4]2[c:5]1[cH:6][c:7]([CH2:10][C:11](=[O:12])[OH:13])[cH:8][cH:9]2>>[n:1]1[cH:2][nH:3][c:4]2[c:5]1[cH:6][c:7]([CH2:10][C:11](=[O:13])[N:18]1[CH2:17][CH2:16][C:15]([OH:14])([c:21]3[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]3)[CH2:20][CH2:19]1)[cH:8][cH:9]2

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 752554-[3-(Trifluoromethyl)phenyl]-4-piperidinolHCID 30466112-(1H-Benzo[d]imidazol-6-yl)acetic acid

Product 1

HCID 1785201931-[4-Hydroxy-4-(3-(trifluoromethyl)phenyl)-1-piperidinyl]-2-(6-benzimidazolyl)-1-ethanone

Sources & evidence

ORD record
ord-025b0ecc4eb84dacba701a7c7fa06f9e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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