Dichloromethane → (1,5-dimethyl-1H-pyrazol-3-yl)-{4-[4-(4-methanesulfonyl-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidin-1-yl}-methanone

HRID 1539984

Reaction equation

HRID 1539984 reaction equation
[CH3:43][n:44]1[n:45][c:46]([C:50](=[O:51])[Cl:52])[cH:47][c:48]1[CH3:49].[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[n:23]([CH:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[n:24][cH:25]3)[cH:32][cH:33]1.[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[Cl:53][CH2:54][Cl:55].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[n:23]([CH:26]2[CH2:27][CH2:28][N:29]([C:50]([c:46]4[n:45][n:44]([CH3:43])[c:48]([CH3:49])[cH:47]4)=[O:51])[CH2:30][CH2:31]2)[n:24][cH:25]3)[cH:32][cH:33]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 81531DiisopropylethylamineHCID 27763641,5-Dimethyl-1H-Pyrazole-3-Carbonyl ChlorideHCID 57964961HCID 57964961, compound

Product 1

HCID 57964929(1,5-dimethyl-1H-pyrazol-3-yl)-{4-[4-(4-methanesulfonyl-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidin-1-yl}-methanone

Sources & evidence

ORD record
ord-c8af9fd9571a47209e662802dcda6136
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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