Potassium Cation → 5-(3-Chloro-propoxy)-2-(4,4-difluoro-piperidine-1-carbonyl)-pyrrolo[2,3-b]pyridine-1-carboxylic Acid tert-butyl Ester

HRID 140684Notes

Reaction equation

HRID 140684 reaction equation
[Br:34][CH2:35][CH2:36][CH2:37][Cl:38].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([C:18](=[O:19])[N:20]2[CH2:21][CH2:22][C:23]([F:26])([F:27])[CH2:24][CH2:25]2)[cH:10][c:11]2[c:12]1[n:13][cH:14][c:15]([OH:17])[cH:16]2.[C:28](=[O:29])([O-:30])[O-:31].[CH3:39][C:40](=[O:41])[CH2:42][CH3:43].[K+:32].[K+:33]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([C:18](=[O:19])[N:20]2[CH2:21][CH2:22][C:23]([F:26])([F:27])[CH2:24][CH2:25]2)[cH:10][c:11]2[c:12]1[n:13][cH:14][c:15]([O:17][CH2:35][CH2:36][CH2:37][Cl:38])[cH:16]2

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6569Methyl Ethyl KetoneHCID 80061-Bromo-3-chloropropaneHCID 19660Carbonate IonHCID 684239772-(4,4-Difluoro-piperidine-1-carbonyl)-5-hydroxy-pyrrolo[2,3-b]pyridine-1-carboxylic Acid tert-butyl Ester

Product 1

HCID 684252235-(3-Chloro-propoxy)-2-(4,4-difluoro-piperidine-1-carbonyl)-pyrrolo[2,3-b]pyridine-1-carboxylic Acid tert-butyl Ester

Sources & evidence

ORD record
ord-15ddb3e311244cc3aee5a942defef812
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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