4-Aminobenzoic Acid → 4-(4-(1-(2-cyano-1-cyclopentylethyl)-1H-pyrazol-4-yl)-5-methoxypyrimidin-2-ylamino)benzoic Acid

HRID 827126Notes

Reaction equation

HRID 827126 reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][O:49][CH2:50]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([O:22][CH3:23])[c:6](-[c:8]2[cH:9][n:10][n:11]([CH:13]([CH2:14][C:15]#[N:16])[CH:17]3[CH2:18][CH2:19][CH2:20][CH2:21]3)[cH:12]2)[n:7]1.[NH2:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]1.[c:34]1([CH3:35])[cH:36][cH:37][c:38]([S:39]([OH:40])(=[O:41])=[O:42])[cH:43][cH:44]1>>[c:2]1([NH:24][c:25]2[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]2)[n:3][cH:4][c:5]([O:22][CH3:23])[c:6](-[c:8]2[cH:9][n:10][n:11]([CH:13]([CH2:14][C:15]#[N:16])[CH:17]3[CH2:18][CH2:19][CH2:20][CH2:21]3)[cH:12]2)[n:7]1

Participants

5

Reactant 4

HCID 9784-Aminobenzoic AcidHCID 6101p-Toluenesulfonic acidHCID 312751,4-DioxaneHCID 866372913-(4-(2-chloro-5-methoxypyrimidin-4-yl)-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrile

Product 1

HCID 580145474-(4-(1-(2-cyano-1-cyclopentylethyl)-1H-pyrazol-4-yl)-5-methoxypyrimidin-2-ylamino)benzoic Acid

Sources & evidence

ORD record
ord-c58d53c9956447e9b4ebb5e326e7fa03
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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