Trifluoroacetic acid → [6-(6-Amino-3-aza-bicyclo[3.1.0]hex-3-yl)-pyrido[3,4-d]pyrimidin-4-yl]-[3-methyl-4-(pyridin-3-yloxy)-phenyl]-amine

HRID 682323Notes

Reaction equation

HRID 682323 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]1[CH:9]2[CH2:10][N:11]([c:14]3[cH:15][c:16]4[c:17]([n:18][cH:19][n:20][c:21]4[NH:22][c:23]4[cH:24][c:25]([CH3:36])[c:26]([O:29][c:30]5[cH:31][n:32][cH:33][cH:34][cH:35]5)[cH:27][cH:28]4)[cH:37][n:38]3)[CH2:12][CH:13]12)([CH3:5])([CH3:6])[CH3:39].[OH:40][C:41]([C:42]([F:43])([F:44])[F:45])=[O:46]>>[NH2:7][CH:8]1[CH:9]2[CH2:10][N:11]([c:14]3[cH:15][c:16]4[c:17]([n:18][cH:19][n:20][c:21]4[NH:22][c:23]4[cH:24][c:25]([CH3:36])[c:26]([O:29][c:30]5[cH:31][n:32][cH:33][cH:34][cH:35]5)[cH:27][cH:28]4)[cH:37][n:38]3)[CH2:12][CH:13]12

Participants

3

Reactant 2

HCID 6422Trifluoroacetic acidHCID 11249486(3-{4-[3-Methyl-4-(pyridin-3-yloxy)-phenylamino]-pyrido[3,4-d]pyrimidin-6-yl}-3-aza-bicyclo[3.1.0]hex-6-yl)-carbamic acid tert-butyl ester

Product 1

HCID 10224262[6-(6-Amino-3-aza-bicyclo[3.1.0]hex-3-yl)-pyrido[3,4-d]pyrimidin-4-yl]-[3-methyl-4-(pyridin-3-yloxy)-phenyl]-amine

Sources & evidence

ORD record
ord-ad12e06b43394cb5a526299bde30882f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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