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Acetate → 3-{1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}thieno[3,2-c]pyridin-4-amine

HRID 172722
Notes
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Reaction equation

HRID 172722 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([C:11]([CH2:12][c:13]1[c:14]([F:20])[cH:15][cH:16][c:17]([F:19])[cH:18]1)=[O:21])[CH2:6][CH2:5]2.[Br:27][c:28]1[cH:29][s:30][c:31]2[c:32]1[c:33]([NH2:37])[n:34][cH:35][cH:36]2.[C:38](=[O:39])([OH:40])[O-:41].[CH2:50]1[O:51][CH2:52][CH2:53][O:54][CH2:55]1.[CH3:23][C:24](=[O:25])[O-:26].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[K+:22].[Na+:42].[OH2:49]>>[c:2]1(-[c:28]2[cH:29][s:30][c:31]3[c:32]2[c:33]([NH2:37])[n:34][cH:35][cH:36]3)[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([C:11]([CH2:12][c:13]1[c:14]([F:20])[cH:15][cH:16][c:17]([F:19])[cH:18]1)=[O:21])[CH2:6][CH2:5]2
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 175AcetateHCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium IonHCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-Dioxane
HCID 18450797
3-Bromothieno[3,2-c]pyridin-4-amine
HCID 668238625-bromo-1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indole

Product 1

HCID 534676173-{1-[(2,5-difluorophenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}thieno[3,2-c]pyridin-4-amine

Sources & evidence

ORD record
ord-8e91bdc4abc847a9acd122c9b1336ad0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes