1-Methoxy-2-propanol → 1-(4-{3-[7-(2-Methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-ylamino]-phenyl}-piperazin-1-yl)-2-methyl-propan-2-ol

HRID 1209558Notes

Reaction equation

HRID 1209558 reaction equation
[CH3:1][S:2](=[O:3])[c:4]1[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1.[CH3:48][O:49][CH2:50][CH:51]([OH:52])[CH3:53].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[NH2:30][c:31]1[cH:32][c:33]([N:37]2[CH2:38][CH2:39][N:40]([CH2:43][C:44]([CH3:45])([OH:46])[CH3:47])[CH2:41][CH2:42]2)[cH:34][cH:35][cH:36]1>>[c:4]1([NH:30][c:31]2[cH:32][c:33]([N:37]3[CH2:38][CH2:39][N:40]([CH2:43][C:44]([CH3:45])([OH:46])[CH3:47])[CH2:41][CH2:42]3)[cH:34][cH:35][cH:36]2)[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1

Participants

5

Reactant 4

HCID 79001-Methoxy-2-propanolHCID 81531DiisopropylethylamineHCID 580713221-[4-(3-Amino-phenyl)-piperazin-1-yl]-2-methyl-propan-2-olHCID 667107912-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazine

Product 1

HCID 667112421-(4-{3-[7-(2-Methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-ylamino]-phenyl}-piperazin-1-yl)-2-methyl-propan-2-ol

Sources & evidence

ORD record
ord-7310b130d3474d69a5f4e10ac47216aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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