Dichloromethane → 3-[4-[4-(5-Chloro-2-methylphenyl)piperazin-1-yl]-1-(oxan-2-yl)pyrazolo[5,4-d]pyrimidin-3-yl]prop-2-ynyl methanesulfonate

HRID 1233357Notes

Reaction equation

HRID 1233357 reaction equation
[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:41][S:42]([Cl:43])(=[O:44])=[O:45].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH3:33])[c:6]([N:8]2[CH2:9][CH2:10][N:11]([c:14]3[c:15]4[c:16]([n:17][cH:18][n:19]3)[n:20]([CH:27]3[O:28][CH2:29][CH2:30][CH2:31][CH2:32]3)[n:21][c:22]4[C:23]#[C:24][CH2:25][OH:26])[CH2:12][CH2:13]2)[cH:7]1.[Cl:46][CH2:47][Cl:48]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH3:33])[c:6]([N:8]2[CH2:9][CH2:10][N:11]([c:14]3[c:15]4[c:16]([n:17][cH:18][n:19]3)[n:20]([CH:27]3[O:28][CH2:29][CH2:30][CH2:31][CH2:32]3)[n:21][c:22]4[C:23]#[C:24][CH2:25][O:26][S:42]([CH3:41])(=[O:44])=[O:45])[CH2:12][CH2:13]2)[cH:7]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 692463293-[4-[4-(5-Chloro-2-methylphenyl)piperazin-1-yl]-1-(oxan-2-yl)pyrazolo[5,4-d]pyrimidin-3-yl]prop-2-yn-1-ol

Product 1

HCID 866193953-[4-[4-(5-Chloro-2-methylphenyl)piperazin-1-yl]-1-(oxan-2-yl)pyrazolo[5,4-d]pyrimidin-3-yl]prop-2-ynyl methanesulfonate

Sources & evidence

ORD record
ord-2b5d9437b88640ed94a0988d99ce2ac7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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