2-Iodophenol → HCID 54772205, compound

HRID 1565959Notes

Reaction equation

HRID 1565959 reaction equation
[CH3:23][C:24]1([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29][B:30]([C:31]2=[CH:40][CH2:39][C:34]3([CH2:33][CH2:32]2)[O:35][CH2:36][CH2:37][O:38]3)[O:41]1.[NH:42]1[CH2:43][CH:44]([NH:46][C:47]([CH2:48][NH:49][c:50]2[n:51][cH:52][n:53][c:54]3[cH:55][cH:56][c:57]([C:60]([F:61])([F:62])[F:63])[cH:58][c:59]23)=[O:64])[CH2:45]1.[OH:15][c:16]1[c:17]([I:18])[cH:19][cH:20][cH:21][cH:22]1.[OH:1][c:2]1[c:3]([CH:8]2[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1>>[OH:1][c:2]1[c:3]([CH:8]2[CH2:9][CH2:10][CH:11]([N:42]3[CH2:43][CH:44]([NH:46][C:47]([CH2:48][NH:49][c:50]4[n:51][cH:52][n:53][c:54]5[cH:55][cH:56][c:57]([C:60]([F:61])([F:62])[F:63])[cH:58][c:59]45)=[O:64])[CH2:45]3)[CH2:12][CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 107842-IodophenolHCID 36970768-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,4-dioxaspiro(4.5)dec-7-eneHCID 18352378HCID 18352378, compoundHCID 68003594N-(azetidin-3-yl)-2((6-(trifluoromethyl)quinazolin-4-yl)amino)acetamide

Product 1

HCID 54772205HCID 54772205, compound

Sources & evidence

ORD record
ord-f17d13ef27f44e668455febdeb0c4a73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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