2-((2-Chloro-5-(trifluoromethyl)pyrimidin-4-yl)amino)-N-methylbenzamide → Bis(2-hydroxyethyl)(3-methoxy-4-{[4-{[2-(methylcarbamoyl)phenyl]amino}-5-(trifluoromethyl)pyrimidin-2-yl]amino}benzyl)phosphonate

HRID 2325009Notes

Reaction equation

HRID 2325009 reaction equation
[Cl:21][c:22]1[n:23][cH:24][c:25]([C:39]([F:40])([F:41])[F:42])[c:26]([NH:28][c:29]2[c:30]([C:31](=[O:32])[NH:33][CH3:34])[cH:35][cH:36][cH:37][cH:38]2)[n:27]1.[OH:1][CH2:2][CH2:3][O:4][P:5]([O:6][CH2:7][CH2:8][OH:9])(=[O:10])[CH2:11][c:12]1[cH:13][c:14]([O:19][CH3:20])[c:15]([NH2:18])[cH:16][cH:17]1>>[OH:1][CH2:2][CH2:3][O:4][P:5]([O:6][CH2:7][CH2:8][OH:9])(=[O:10])[CH2:11][c:12]1[cH:13][c:14]([O:19][CH3:20])[c:15]([NH:18][c:22]2[n:23][cH:24][c:25]([C:39]([F:40])([F:41])[F:42])[c:26]([NH:28][c:29]3[c:30]([C:31](=[O:32])[NH:33][CH3:34])[cH:35][cH:36][cH:37][cH:38]3)[n:27]2)[cH:16][cH:17]1

Participants

3

Reactant 2

HCID 866338612-((2-Chloro-5-(trifluoromethyl)pyrimidin-4-yl)amino)-N-methylbenzamideHCID 86654012Bis(2-hydroxyethyl)(4-amino-3-methoxybenzyl)phosphonate

Product 1

HCID 49821271Bis(2-hydroxyethyl)(3-methoxy-4-{[4-{[2-(methylcarbamoyl)phenyl]amino}-5-(trifluoromethyl)pyrimidin-2-yl]amino}benzyl)phosphonate

Sources & evidence

ORD record
ord-52f93a9aae3448f49e961501f8dd7821
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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