(3-(Oxiran-2-ylmethoxy)phenyl)methanol → 1-(1-(5-(4-Fluorophenyl)thieno[2,3-d]pyrimidin-4-yl)piperidin-4-ylamino)-3-(3-(hydroxymethyl)phenoxy)propan-2-ol

HRID 2145186Notes

Reaction equation

HRID 2145186 reaction equation
[F:14][c:15]1[cH:16][cH:17][c:18](-[c:21]2[cH:22][s:23][c:24]3[n:25][cH:26][n:27][c:28]([N:30]4[CH2:31][CH2:32][CH:33]([NH2:36])[CH2:34][CH2:35]4)[c:29]23)[cH:19][cH:20]1.[O:1]1[CH:2]([CH2:4][O:5][c:6]2[cH:7][c:8]([CH2:12][OH:13])[cH:9][cH:10][cH:11]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][NH:36][CH:33]1[CH2:32][CH2:31][N:30]([c:28]2[n:27][cH:26][n:25][c:24]3[s:23][cH:22][c:21](-[c:18]4[cH:17][cH:16][c:15]([F:14])[cH:20][cH:19]4)[c:29]32)[CH2:35][CH2:34]1)[CH2:4][O:5][c:6]1[cH:7][c:8]([CH2:12][OH:13])[cH:9][cH:10][cH:11]1

Participants

3

Reactant 2

HCID 19385010(3-(Oxiran-2-ylmethoxy)phenyl)methanolHCID 690409951-(5-(4-Fluorophenyl)thieno[2,3-d]pyrimidin-4-yl)piperidin-4-amine

Product 1

HCID 249371421-(1-(5-(4-Fluorophenyl)thieno[2,3-d]pyrimidin-4-yl)piperidin-4-ylamino)-3-(3-(hydroxymethyl)phenoxy)propan-2-ol

Sources & evidence

ORD record
ord-6d5205bf675940e89ea3172753ccc5ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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