Acetate → HCID 68681499, compound

HRID 2155008Notes

Reaction equation

HRID 2155008 reaction equation
[C:52]([O-:53])(=[O:54])[CH3:55].[C:57]([O-:58])(=[O:59])[CH3:60].[CH3:33][c:34]1[cH:35][cH:36][c:37]([B:40]([OH:41])[OH:42])[cH:38][cH:39]1.[CH:1]1([N:6]2[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]3[cH:15][c:16]4[cH:17][c:18]([C:23](=[O:24])[N:25]5[CH2:26][CH2:27][C:28]([F:31])([F:32])[CH2:29][CH2:30]5)[nH:19][c:20]4[cH:21][cH:22]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:49][CH2:50][Cl:51].[Cu+2:56].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[CH:1]1([N:6]2[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]3[cH:15][c:16]4[cH:17][c:18]([C:23](=[O:24])[N:25]5[CH2:26][CH2:27][C:28]([F:31])([F:32])[CH2:29][CH2:30]5)[n:19](-[c:37]5[cH:36][cH:35][c:34]([CH3:33])[cH:39][cH:38]5)[c:20]4[cH:21][cH:22]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 1049PyridineHCID 6344DichloromethaneHCID 27099Cupric cationHCID 79799Tolylboronic acidHCID 68681312[5-(4-Cyclopentyl-piperazine-1-carbonyl)-1H-indol-2-yl]-(4,4-difluoro-piperidin-1-yl)-methanone

Product 1

HCID 68681499HCID 68681499, compound

Sources & evidence

ORD record
ord-ef55bc06d00e4cf8ba986b398b571945
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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