Water → 3-[[2,6-Dichloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)phenyl]phenyl]methyl]-1-(4-hydroxypiperidin-1-yl)pyrrolidin-2-one

HRID 2344087Notes

Reaction equation

HRID 2344087 reaction equation
[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[Cl:9][c:10]1[cH:11][c:12](-[c:41]2[cH:42][cH:43][c:44]([C:47](=[O:48])[N:49]3[CH2:50][CH2:51][C:52]([F:55])([F:56])[CH2:53][CH2:54]3)[cH:45][cH:46]2)[cH:13][c:14]([Cl:40])[c:15]1[CH2:16][CH:17]1[C:18](=[O:39])[N:19]([N:22]2[CH2:23][CH2:24][CH:25]([O:28][Si:29]([CH:30]([CH3:31])[CH3:32])([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[CH2:26][CH2:27]2)[CH2:20][CH2:21]1.[F:2][C:3]([F:4])([F:5])[C:6]([OH:7])=[O:8].[OH2:1]>>[Cl:9][c:10]1[cH:11][c:12](-[c:41]2[cH:42][cH:43][c:44]([C:47](=[O:48])[N:49]3[CH2:50][CH2:51][C:52]([F:55])([F:56])[CH2:53][CH2:54]3)[cH:45][cH:46]2)[cH:13][c:14]([Cl:40])[c:15]1[CH2:16][CH:17]1[C:18](=[O:39])[N:19]([N:22]2[CH2:23][CH2:24][CH:25]([OH:28])[CH2:26][CH2:27]2)[CH2:20][CH2:21]1

Participants

5

Reactant 4

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 66905190HCID 66905190, compound

Product 1

HCID 669049953-[[2,6-Dichloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)phenyl]phenyl]methyl]-1-(4-hydroxypiperidin-1-yl)pyrrolidin-2-one

Sources & evidence

ORD record
ord-8367411fdae4471b8da807dc5a07f848
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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