Hydroxide → N-(3-{3-[2-(1,2,3,4-tetrahydro-7-isoquinolinylamino)-4-pyrimidinyl]-pyrazolo[1,5-a]pyridin-2-yl}phenyl)benzamide

HRID 1566337Notes

Reaction equation

HRID 1566337 reaction equation
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[F:1][C:2]([F:3])([F:4])[C:46]([N:5]1[CH2:6][c:7]2[cH:8][c:9]([NH:15][c:16]3[n:17][cH:18][cH:19][c:20](-[c:22]4[c:23](-[c:31]5[cH:32][c:33]([NH:37][C:38]([c:39]6[cH:40][cH:41][cH:42][cH:43][cH:44]6)=[O:45])[cH:34][cH:35][cH:36]5)[n:24][n:25]5[c:26]4[cH:27][cH:28][cH:29][cH:30]5)[n:21]3)[cH:10][cH:11][c:12]2[CH2:13][CH2:14]1)=[O:47].[Li+:49].[OH-:48].[OH2:50].[OH2:56]>>[NH:5]1[CH2:6][c:7]2[cH:8][c:9]([NH:15][c:16]3[n:17][cH:18][cH:19][c:20](-[c:22]4[c:23](-[c:31]5[cH:32][c:33]([NH:37][C:38]([c:39]6[cH:40][cH:41][cH:42][cH:43][cH:44]6)=[O:45])[cH:34][cH:35][cH:36]5)[n:24][n:25]5[c:26]4[cH:27][cH:28][cH:29][cH:30]5)[n:21]3)[cH:10][cH:11][c:12]2[CH2:13][CH2:14]1

Participants

6

Reactant 5

HCID 961HydroxideHCID 962Water2×HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 59513753N-{3-[3-(2-{[2-(2,2,2-Trifluoroacetyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]amino}-4-pyrimidinyl)pyrazolo[1,5-a]pyridin-2-yl]phenyl}benzamide

Product 1

HCID 59513880N-(3-{3-[2-(1,2,3,4-tetrahydro-7-isoquinolinylamino)-4-pyrimidinyl]-pyrazolo[1,5-a]pyridin-2-yl}phenyl)benzamide

Sources & evidence

ORD record
ord-161ee393425a47c9b04750644dd648a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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