Hydrochloric Acid → Hydrochloric Acid

HRID 2339352Notes

Reaction equation

HRID 2339352 reaction equation
[CH2:30]1[CH2:31][O:32][CH2:33][CH2:34][NH:35]1.[Cl:1][c:2]1[cH:3][c:4]([NH:21][c:22]2[n:23][nH:24][c:25]([CH:27]3[CH2:28][CH2:29]3)[cH:26]2)[n:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[n:13][o:14]2)[n:7]1.[ClH:36].[OH2:37]>>[ClH:1].[c:2]1([N:35]2[CH2:30][CH2:31][O:32][CH2:33][CH2:34]2)[cH:3][c:4]([NH:21][c:22]2[n:23][nH:24][c:25]([CH:27]3[CH2:28][CH2:29]3)[cH:26]2)[n:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[n:13][o:14]2)[n:7]1

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 962WaterHCID 8083MorpholineHCID 116686486-Chloro-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(3-phenylisoxazol-5-ylmethyl)-pyrimidine-2,4-diamine

Product 2

HCID 313Hydrochloric AcidHCID 115253944-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-morpholin-4-yl-2-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-31f5eebaa60b4d2c9984f489b53e1f4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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