1,4-Dioxane → (4-Benzyloxy-phenyl)-(6-(3-(1,3-dioxolan-2-yl)-phenyl)-pyrido[3,4-d]pyrimidin-4-yl)-amine

HRID 155834Notes

Reaction equation

HRID 155834 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([NH:15][c:16]2[c:17]3[c:18]([n:19][cH:20][n:21]2)[cH:22][n:23][c:24]([Cl:26])[cH:25]3)[cH:13][cH:14]1.[O:27]1[CH:28]([c:32]2[cH:33][c:34]([Sn:38]([CH2:39][CH2:40][CH2:41][CH3:42])([CH2:43][CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH2:49][CH3:50])[cH:35][cH:36][cH:37]2)[O:29][CH2:30][CH2:31]1.[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([NH:15][c:16]2[c:17]3[c:18]([n:19][cH:20][n:21]2)[cH:22][n:23][c:24](-[c:34]2[cH:33][c:32]([CH:28]4[O:27][CH2:31][CH2:30][O:29]4)[cH:37][cH:36][cH:35]2)[cH:25]3)[cH:13][cH:14]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 152549343-(1,3-Dioxolan-2-yl)-phenyl-tributylstannaneHCID 219521684-(4-Benzyloxyanilino)6-chloropyrido[3,4-d]pyrimidine

Product 1

HCID 22725131(4-Benzyloxy-phenyl)-(6-(3-(1,3-dioxolan-2-yl)-phenyl)-pyrido[3,4-d]pyrimidin-4-yl)-amine

Sources & evidence

ORD record
ord-74b36b722fb649d8bf341abee9becf39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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