Hydrochloric Acid → 1,3-Dioxo-8a-pridin-2-ylmethyl-2-(2,2,2-trifluoro-ethyl)-hexahydroimidazo [1,5-a]pyrazine-7-carboxylic acid tert-butyl ester

HRID 200613Notes

Reaction equation

HRID 200613 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]2[N:11]([CH2:12][CH2:13]1)[C:14](=[O:23])[N:15]([CH2:18][C:19]([F:20])([F:21])[F:22])[C:16]2=[O:17].[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:24][Si:25]([N-:26][Si:27]([CH3:28])([CH3:29])[CH3:30])([CH3:31])[CH3:32].[ClH:42].[K+:33].[K+:56].[K+:57].[N:48]12[CH2:49][CH2:50][N:51]([CH2:52][CH2:53]1)[CH2:54][CH2:55]2.[Na+:47].[O-:43][C:44]([OH:45])=[O:46].[O-:58][C:59]([O-:60])=[O:61].[c:34]1([CH2:40][Cl:41])[cH:35][cH:36][cH:37][cH:38][n:39]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][C:10]2([CH2:40][c:34]3[cH:35][cH:36][cH:37][cH:38][n:39]3)[N:11]([CH2:12][CH2:13]1)[C:14](=[O:23])[N:15]([CH2:18][C:19]([F:20])([F:21])[F:22])[C:16]2=[O:17]

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 813Potassium Cation3×HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 9237DabcoHCID 19660Carbonate IonHCID 23393Picolyl chlorideHCID 3280088Npc316347HCID 111867551,3-Dioxo-2-(2,2,2-trifluoro-ethyl)-hexahydro-imidazo[1,5-a]pyrazine-7-carboxylic acid tert-butyl ester

Product 1

HCID 113163151,3-Dioxo-8a-pridin-2-ylmethyl-2-(2,2,2-trifluoro-ethyl)-hexahydroimidazo [1,5-a]pyrazine-7-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-1c84b4e6a74a420f89c6fd8a3c97ad32
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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