Hydrochloric Acid → Methyl 2-(5-chloro-2-(5-methoxy-2-methyl-4'-(methylcarbamoyl)biphenyl-4-ylamino)pyrimidin-4-ylamino)benzoate

HRID 281689Notes

Reaction equation

HRID 281689 reaction equation
[CH3:41][CH:42]([OH:43])[CH3:44].[Cl:1][c:2]1[n:3][cH:4][c:5]([Cl:19])[c:6]([NH:8][c:9]2[c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][cH:16][cH:17][cH:18]2)[n:7]1.[ClH:40].[NH2:20][c:21]1[cH:22][c:23]([CH3:39])[c:24](-[c:29]2[cH:30][cH:31][c:32]([C:35](=[O:36])[NH:37][CH3:38])[cH:33][cH:34]2)[cH:25][c:26]1[O:27][CH3:28]>>[c:2]1([NH:20][c:21]2[cH:22][c:23]([CH3:39])[c:24](-[c:29]3[cH:30][cH:31][c:32]([C:35](=[O:36])[NH:37][CH3:38])[cH:33][cH:34]3)[cH:25][c:26]2[O:27][CH3:28])[n:3][cH:4][c:5]([Cl:19])[c:6]([NH:8][c:9]2[c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][cH:16][cH:17][cH:18]2)[n:7]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 595867914'-Amino-5'-methoxy-N,2'-dimethylbiphenyl-4-carboxamideHCID 86647794Methyl 2-((2,5-dichloropyrimidin-4-yl)amino)benzoate

Product 1

HCID 68512573Methyl 2-(5-chloro-2-(5-methoxy-2-methyl-4'-(methylcarbamoyl)biphenyl-4-ylamino)pyrimidin-4-ylamino)benzoate

Sources & evidence

ORD record
ord-422d033b4b4e454588cb798705b18748
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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