2-Amino-2-methyl-1-propanol → 5-fluoro-N2-[2-(2-hydroxy-1,1-dimethylethylamino)carbonylbenzofuran-5-yl]-N4-(3-hydroxyphenyl)-2,4-pyrimidinediamine

HRID 305760Notes

Reaction equation

HRID 305760 reaction equation
[F:1][c:2]1[c:3]([NH:22][c:23]2[cH:24][c:25]([OH:29])[cH:26][cH:27][cH:28]2)[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:14][c:15]([C:17](=[O:18])[O:19][CH3:20])[o:16]3)[cH:21]2)[n:6][cH:7]1.[NH2:30][C:31]([CH2:32][OH:33])([CH3:34])[CH3:35]>>[F:1][c:2]1[c:3]([NH:22][c:23]2[cH:24][c:25]([OH:29])[cH:26][cH:27][cH:28]2)[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:14][c:15]([C:17](=[O:18])[NH:30][C:31]([CH2:32][OH:33])([CH3:34])[CH3:35])[o:16]3)[cH:21]2)[n:6][cH:7]1

Participants

3

Reactant 2

HCID 118072-Amino-2-methyl-1-propanolHCID 220602755-fluoro-N4-(3-hydroxyphenyl)-N2-(2-methoxycarbonylbenzofuran-5-yl)-2,4-pyrimidinediamine

Product 1

HCID 116265865-fluoro-N2-[2-(2-hydroxy-1,1-dimethylethylamino)carbonylbenzofuran-5-yl]-N4-(3-hydroxyphenyl)-2,4-pyrimidinediamine

Sources & evidence

ORD record
ord-8faff4aa5902428fa0785f6589acc1db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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