Hydrochloric Acid → 5-{1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}-7-[2-(4-piperidinyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

HRID 1206525Notes

Reaction equation

HRID 1206525 reaction equation
[ClH:46].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH2:31][CH2:32][CH:33]1[CH2:34][CH2:35][N:36]([C:39]([O:40][C:41]([CH3:42])([CH3:43])[CH3:44])=[O:45])[CH2:37][CH2:38]1)[cH:9][c:10]2-[c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[N:16]([C:20]([CH2:21][c:22]1[c:23]([F:29])[cH:24][cH:25][c:26]([F:28])[cH:27]1)=[O:30])[CH2:15][CH2:14]2.[O:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH2:31][CH2:32][CH:33]1[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1)[cH:9][c:10]2-[c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[N:16]([C:20]([CH2:21][c:22]1[c:23]([F:29])[cH:24][cH:25][c:26]([F:28])[cH:27]1)=[O:30])[CH2:15][CH2:14]2

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 668239521,1-dimethylethyl 4-[2-(4-amino-5-{1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]-1-piperidinecarboxylate

Product 1

HCID 668236715-{1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}-7-[2-(4-piperidinyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Sources & evidence

ORD record
ord-caed011dfd1f4e6682e6a74ddf5c9c87
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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