Tetrahydrofuran → 8-(1-((3,5-difluorophenyl)(methyl)amino)ethyl)-6-(4-hydroxypiperidine-1-carbonyl)-2-morpholino-4H-chromen-4-one

HRID 150841Notes

Reaction equation

[C:19]([Si:20]([c:21]1[cH:22][cH:23][cH:62][cH:63][cH:64]1)([O:24][CH:25]1[CH2:26][CH2:27][N:28]([C:31](=[O:32])[c:33]2[cH:34][c:35]3[c:36](=[O:61])[cH:37][c:38]([N:55]4[CH2:56][CH2:57][O:58][CH2:59][CH2:60]4)[o:39][c:40]3[c:41]([CH:43]([CH3:44])[N:45]([CH3:46])[c:47]3[cH:48][c:49]([F:54])[cH:50][c:51]([F:53])[cH:52]3)[cH:42]2)[CH2:29][CH2:30]1)[c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1)([CH3:71])([CH3:72])[CH3:73].[CH2:74]1[O:75][CH2:76][CH2:77][CH2:78]1.[CH3:2][CH2:3][CH2:4][CH2:5][N+:6]([CH2:7][CH2:8][CH2:9][CH3:10])([CH2:11][CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH2:17][CH3:18].[F-:1]>>[OH:24][CH:25]1[CH2:26][CH2:27][N:28]([C:31](=[O:32])[c:33]2[cH:34][c:35]3[c:36](=[O:61])[cH:37][c:38]([N:55]4[CH2:56][CH2:57][O:58][CH2:59][CH2:60]4)[o:39][c:40]3[c:41]([CH:43]([CH3:44])[N:45]([CH3:46])[c:47]3[cH:48][c:49]([F:54])[cH:50][c:51]([F:53])[cH:52]3)[cH:42]2)[CH2:29][CH2:30]1

Participants

Reactant 4

HCID 8028Tetrahydrofuran

HCID 16028Tetrabutylammonium

HCID 28179Fluoride Ion

HCID 671037136-(4-(tert-butyldiphenylsilyloxy)piperidine-1-carbonyl)-8-(1-((3,5-difluorophenyl)(methyl)amino)ethyl)-2-morpholino-4H-chromen-4-one

Product 1

HCID 582349708-(1-((3,5-difluorophenyl)(methyl)amino)ethyl)-6-(4-hydroxypiperidine-1-carbonyl)-2-morpholino-4H-chromen-4-one

Sources & evidence

ORD record: ord-05a89c5a58564d52be9c3261485a50c8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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