Bicarbonate Ion → 4-Benzylsulfinyl-5-methoxycarbonyl-6-(4-hydroxypiperidin-1-yl)-2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)pyrimidine

HRID 111478

Reaction equation

HRID 111478 reaction equation
[C:50](=[O:51])([O-:52])[OH:53].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][c:9]1[n:10][c:11]([N:26]2[CH2:27][c:28]3[n:29]([cH:32][cH:33][n:34]3)[CH2:30][CH2:31]2)[n:12][c:13]([N:19]2[CH2:20][CH2:21][CH:22]([OH:25])[CH2:23][CH2:24]2)[c:14]1[C:15](=[O:16])[O:17][CH3:18].[CH:46]([Cl:47])([Cl:48])[Cl:49].[Cl:35][c:36]1[cH:37][cH:38][cH:39][c:40]([C:41]([O:42][OH:44])=[O:43])[cH:45]1.[Na+:54]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8]([c:9]1[n:10][c:11]([N:26]2[CH2:27][c:28]3[n:29]([cH:32][cH:33][n:34]3)[CH2:30][CH2:31]2)[n:12][c:13]([N:19]2[CH2:20][CH2:21][CH:22]([OH:25])[CH2:23][CH2:24]2)[c:14]1[C:15](=[O:16])[O:17][CH3:18])=[O:43]

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6212ChloroformHCID 70297m-Chloroperbenzoic acidHCID 178482774-Benzylthio-5-methoxycarbonyl-6-(4-hydroxypiperidin-1-yl)-2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)pyrimidine

Product 1

HCID 178483354-Benzylsulfinyl-5-methoxycarbonyl-6-(4-hydroxypiperidin-1-yl)-2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)pyrimidine

Sources & evidence

ORD record
ord-f674b6cab63a434b8db48a956e50b21f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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