Hydrogen Peroxide → dibenzyl 1-(4-(6-(4-chlorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)-2-methoxyphenoxy)-2-methylpropan-2-yl phosphate

HRID 1209306Notes

Reaction equation

HRID 1209306 reaction equation
[CH:37]([N:38]([CH:39]([CH3:40])[CH3:58])[P:41]([O:42][CH2:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[O:50][CH2:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)([CH3:59])[CH3:60].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[n:11][cH:12][n:13](-[c:18]4[cH:19][c:20]([O:30][CH3:31])[c:21]([O:24][CH2:25][C:26]([CH3:27])([CH3:28])[OH:29])[cH:22][cH:23]4)[c:14](=[O:17])[c:15]3[s:16]2)[cH:6][cH:7]1.[Cl:64][CH2:65][Cl:66].[OH2:63].[OH:61][OH:62].[nH:32]1[cH:33][n:34][cH:35][n:36]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[n:11][cH:12][n:13](-[c:18]4[cH:19][c:20]([O:30][CH3:31])[c:21]([O:24][CH2:25][C:26]([CH3:27])([CH3:28])[O:29][P:41]([O:42][CH2:43][c:44]5[cH:45][cH:46][cH:47][cH:48][cH:49]5)([O:50][CH2:51][c:52]5[cH:53][cH:54][cH:55][cH:56][cH:57]5)=[O:61])[cH:22][cH:23]4)[c:14](=[O:17])[c:15]3[s:16]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 784Hydrogen PeroxideHCID 962WaterHCID 6344DichloromethaneHCID 92571H-1,2,4-TriazoleHCID 196621Bis(benzyloxy)(diisopropylamino)phosphineHCID 167186196-(4-chlorophenyl)-3-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one

Product 1

HCID 58858116dibenzyl 1-(4-(6-(4-chlorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)-2-methoxyphenoxy)-2-methylpropan-2-yl phosphate

Sources & evidence

ORD record
ord-3eb962c972fd427db3555169ce4b6b12
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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