Potassium Cation → HCID 49848668, compound

HRID 141375Notes

Reaction equation

HRID 141375 reaction equation
[C:37]([O:38][C:39](=[O:40])[N:44]1[CH:45]2[CH2:46][NH:47][CH:48]([CH2:49]1)[CH2:50]2)([CH3:41])([CH3:42])[CH3:43].[CH3:51][C:52]#[N:53].[Cl:1][CH2:2][c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]3[c:14]([c:15]([CH3:17])[cH:16]2)[C:13](=[O:18])[N:12]([CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][C:27]([F:28])([F:29])[F:30])[cH:24][cH:25]2)[CH2:11]3)[n:6][o:7]1.[K+:31].[K+:32].[O-:33][C:34]([O-:35])=[O:36].[OH2:54]>>[CH2:2]([c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]3[c:14]([c:15]([CH3:17])[cH:16]2)[C:13](=[O:18])[N:12]([CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][C:27]([F:28])([F:29])[F:30])[cH:24][cH:25]2)[CH2:11]3)[n:6][o:7]1)[N:44]1[CH:45]2[CH2:46][NH:47][CH:48]([CH2:49]1)[CH2:50]2

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6342AcetonitrileHCID 19660Carbonate IonHCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylateHCID 59465461HCID 59465461, compound

Product 1

HCID 49848668HCID 49848668, compound

Sources & evidence

ORD record
ord-bdbcd10d5db94943b05aac71b51d9d97
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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