HCID 118663246, compound → HCID 137646576, compound

HRID 2021151Notes

Reaction equation

HRID 2021151 reaction equation
[CH3:1][c:2]1[c:19](B2OC(C)(C)C(C)(C)O2)[cH:18][c:17]([c:4]3[cH:3]1)[C:15](=[O:16])[N:7]([C@@H:8]4[C@@H:13]([OH:14])[CH2:12][O:11][CH2:10][CH2:9]4)[CH2:6][CH2:5]3.[CH3:20][c:21]1[n:25][c:24]([c:26]2[cH:32][cH:31][c:29]([CH2:30]Cl)[cH:28][cH:27]2)[cH:23][o:22]1>>[CH3:20][c:21]1[n:25][c:24]([c:26]2[cH:32][cH:31][c:29]([CH2:30][c:19]3[c:2]([CH3:1])[cH:3][c:4]([c:17]4[cH:18]3)[CH2:5][CH2:6][N:7]([C@@H:8]5[C@@H:13]([OH:14])[CH2:12][O:11][CH2:10][CH2:9]5)[C:15]4=[O:16])[cH:28][cH:27]2)[cH:23][o:22]1

Participants

8

Reactant 2

HCID 118663246HCID 118663246, compoundHCID 178421824HCID 178421824, compound

Product 1

HCID 137646576HCID 137646576, compound

Reagents, catalysts & solvents 5

HCID 962WaterReagentHCID 516892Sodium BicarbonateReagentHCID 2734558Bis(tri-tert-butylphosphine)palladium(0)CatalystHCID 6342AcetonitrileSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
100 °C

Sources & evidence

ORD record
ord-83bda4ad78bd4a628c64ccc0ecfe8c22
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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