Ethyl 3-aminobenzoate → N2-(3-ethoxycarbonylphenyl)-N4-(3,4-ethylenedioxyphenyl)-5-fluoro-2,4-pyrimidinediamine

HRID 833952Notes

Reaction equation

HRID 833952 reaction equation
[CH2:1]1[O:2][c:3]2[cH:4][c:5]([NH:11][c:12]3[n:13][c:14]([NH:19][c:20]4[cH:21][c:22]([OH:26])[cH:23][cH:24][cH:25]4)[n:15][cH:16][c:17]3[F:18])[cH:6][cH:7][c:8]2[O:9][CH2:10]1.[CH2:46]([CH3:47])[O:48][C:49](=[O:50])[c:51]1[cH:52][c:53]([NH2:57])[cH:54][cH:55][cH:56]1.[Cl:27][c:28]1[n:29][c:30]([NH:31][c:32]2[cH:33][cH:34][c:35]3[c:40]([cH:41]2)[O:39][CH2:38][CH2:37][O:36]3)[c:42]([F:43])[cH:44][n:45]1>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]([NH:11][c:12]3[n:13][c:14]([NH:19][c:20]4[cH:21][c:22]([C:49]([O:48][CH2:46][CH3:47])=[O:50])[cH:23][cH:24][cH:25]4)[n:15][cH:16][c:17]3[F:18])[cH:6][cH:7][c:8]2[O:9][CH2:10]1

Participants

4

Reactant 3

HCID 11400Ethyl 3-aminobenzoateHCID 22060334N4-(3,4-ethylenedioxyphenyl)-5-fluoro-N2-(3-hydroxyphenyl)-2,4-primidinediamineHCID 220603622-chloro-5-fluoro-N-(3,4-ethylenedioxyphenyl)-4-pyrimidineamine

Product 1

HCID 22060933N2-(3-ethoxycarbonylphenyl)-N4-(3,4-ethylenedioxyphenyl)-5-fluoro-2,4-pyrimidinediamine

Sources & evidence

ORD record
ord-43b0d3a1464a4538b6aa5404f3f46225
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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