Methyl 5-aminobenzofuran-2-carboxylate → 5-fluoro-N2-(2-methoxycarbonylbenzofuran-5-yl)-N4-(4-isopropoxyphenyl)-2,4-pyrimidinediamine

HRID 314101Notes

Reaction equation

HRID 314101 reaction equation
[CH2:1]1[CH2:2][O:3][c:4]2[cH:5][cH:6][c:7]([NH:8][c:9]3[c:10]([F:11])[cH:12][n:13][c:14]([NH:15][c:16]4[cH:17][cH:18][cH:19][c:20]([OH:21])[cH:22]4)[n:23]3)[cH:24][c:25]2[O:26]1.[CH3:46][O:47][C:48](=[O:49])[c:50]1[o:51][c:52]2[c:53]([cH:54]1)[cH:55][c:56]([NH2:59])[cH:57][cH:58]2.[Cl:27][c:28]1[n:29][cH:30][c:31]([F:45])[c:32]([NH:34][c:35]2[cH:36][cH:37][c:38]([O:41][CH:42]([CH3:43])[CH3:44])[cH:39][cH:40]2)[n:33]1>>[c:28]1([NH:59][c:56]2[cH:55][c:53]3[c:52]([o:51][c:50]([C:48]([O:47][CH3:46])=[O:49])[cH:54]3)[cH:58][cH:57]2)[n:29][cH:30][c:31]([F:45])[c:32]([NH:34][c:35]2[cH:36][cH:37][c:38]([O:41][CH:42]([CH3:43])[CH3:44])[cH:39][cH:40]2)[n:33]1

Participants

4

Reactant 3

HCID 10845388Methyl 5-aminobenzofuran-2-carboxylateHCID 22060334N4-(3,4-ethylenedioxyphenyl)-5-fluoro-N2-(3-hydroxyphenyl)-2,4-primidinediamineHCID 220607632-chloro-5-fluoro-N-(4-isopropoxyphenyl)-4-pyrimidineamine

Product 1

HCID 220603265-fluoro-N2-(2-methoxycarbonylbenzofuran-5-yl)-N4-(4-isopropoxyphenyl)-2,4-pyrimidinediamine

Sources & evidence

ORD record
ord-1bb5a9eb200a4e96bf12910ef4e48999
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…