HCID 178419120, compound → HCID 74982610, compound

HRID 2016307Notes

Reaction equation

HRID 2016307 reaction equation
B([C@H]1CCC2)[C@H]2CCC1.[CH2:1]=[CH:2][CH2:3][CH2:4][c:5]1[s:19][c:8]([NH:9][C:10]([CH2:12][c:13]2[n:18][cH:17][cH:16][cH:15][cH:14]2)=[O:11])[n:7][n:6]1.Br[c:20]1[n:35][n:34][c:23]([NH:24][C:25]([CH2:27][c:28]2[cH:33][cH:32][cH:31][cH:30][cH:29]2)=[O:26])[cH:22][cH:21]1>>[O:26]=[C:25]([NH:24][c:23]1[n:34][n:35][c:20]([CH2:1][CH2:2][CH2:3][CH2:4][c:5]2[s:19][c:8]([NH:9][C:10]([CH2:12][c:13]3[n:18][cH:17][cH:16][cH:15][cH:14]3)=[O:11])[n:7][n:6]2)[cH:21][cH:22]1)[CH2:27][c:28]4[cH:33][cH:32][cH:31][cH:30][cH:29]4

Participants

9

Reactant 3

HCID 178419120HCID 178419120, compoundHCID 178441950HCID 178441950, compoundHCID 178520220HCID 178520220, compound

Product 1

HCID 74982610HCID 74982610, compound

Reagents, catalysts & solvents 5

HCID 962WaterReagentHCID 516892Sodium BicarbonateReagentHCID 11979704Tetrakis(triphenylphosphine)palladiumCatalystHCID 1140TolueneSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
100 °C

Sources & evidence

ORD record
ord-d5cee534e17b42b3aa8fb684cf2dcd40
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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