Dichloromethane → Merestinib

HRID 2128730Notes

Reaction equation

HRID 2128730 reaction equation
[CH2:49]([SiH:50]([CH2:51][CH3:52])[CH2:53][CH3:54])[CH3:55].[Cl:63][CH2:64][Cl:65].[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]3[cH:8][n:9][n:10]([CH3:26])[c:11]3[cH:12][c:13]2-[c:14]2[cH:15][n:16][n:17]([C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[cH:18]2)[cH:27][cH:28][c:29]([NH:31][C:32](=[O:33])[c:34]2[c:35](=[O:48])[n:36](-[c:41]3[cH:42][cH:43][c:44]([F:47])[cH:45][cH:46]3)[c:37]([CH3:40])[cH:38][cH:39]2)[cH:30]1.[F:56][C:57]([F:58])([F:59])[C:60]([OH:61])=[O:62]>>[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]3[cH:8][n:9][n:10]([CH3:26])[c:11]3[cH:12][c:13]2-[c:14]2[cH:15][n:16][nH:17][cH:18]2)[cH:27][cH:28][c:29]([NH:31][C:32](=[O:33])[c:34]2[c:35](=[O:48])[n:36](-[c:41]3[cH:42][cH:43][c:44]([F:47])[cH:45][cH:46]3)[c:37]([CH3:40])[cH:38][cH:39]2)[cH:30]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 12052TriethylsilaneHCID 66766832HCID 66766832, compound

Product 1

HCID 44603533Merestinib

Sources & evidence

ORD record
ord-3d04204b92fe45c189a75b4591ffd6ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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