Acetate → Doramapimod

HRID 689582Notes

Reaction equation

HRID 689582 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][cH:16][c:17]([O:24][CH2:25][CH2:26][N:27]3[CH2:28][CH2:29][O:30][CH2:31][CH2:32]3)[c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]23)[nH:8][n:9]1.[C:49]([O-:50])(=[O:51])[CH3:52].[C:54]([O-:55])(=[O:56])[CH3:57].[CH2:58]([Cl:59])[Cl:60].[Cu+2:53].[c:33]1([CH3:42])[cH:34][cH:35][c:36]([B:39]([OH:40])[OH:41])[cH:37][cH:38]1.[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][cH:16][c:17]([O:24][CH2:25][CH2:26][N:27]3[CH2:28][CH2:29][O:30][CH2:31][CH2:32]3)[c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]23)[n:8](-[c:36]2[cH:35][cH:34][c:33]([CH3:42])[cH:38][cH:37]2)[n:9]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 1049PyridineHCID 6344DichloromethaneHCID 27099Cupric cationHCID 79799Tolylboronic acidHCID 178441175HCID 178441175, compound

Product 1

HCID 156422Doramapimod

Sources & evidence

ORD record
ord-61649aab73d14974a814ed5ba1007723
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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