Ethanol → 6-chloro-N-[2-(4-methoxyphenyl)-4,4a,5,6,7,7a-hexahydrocyclopenta[d][1,3]dioxin-6-yl]pyrimidin-4-amine

HRID 147511Notes

Reaction equation

HRID 147511 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[O:10][CH2:11][CH:12]3[CH:13]([O:14]2)[CH2:15][CH:16]([NH2:18])[CH2:17]3)[cH:7][cH:8]1.[CH3:36][CH2:37][OH:38].[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[Cl:19][c:20]1[n:21][cH:22][n:23][c:24]([Cl:26])[cH:25]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[O:10][CH2:11][CH:12]3[CH:13]([O:14]2)[CH2:15][CH:16]([NH:18][c:24]2[n:23][cH:22][n:21][c:20]([Cl:19])[cH:25]2)[CH2:17]3)[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 702EthanolHCID 709434,6-DichloropyrimidineHCID 81531DiisopropylethylamineHCID 178489192HCID 178489192, compound

Product 1

HCID 723538876-chloro-N-[2-(4-methoxyphenyl)-4,4a,5,6,7,7a-hexahydrocyclopenta[d][1,3]dioxin-6-yl]pyrimidin-4-amine

Sources & evidence

ORD record
ord-5add1605100e4bae91fd97cfc214d6d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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