Methane → Tert-butyl 4-(2-aminophenyl)-2-(5-phenylpyridine-3-carboxamido)benzoate

HRID 170716Notes

Reaction equation

HRID 170716 reaction equation
[C:44].[CH3:42][OH:43].[CH:38]([Cl:39])([Cl:40])[Cl:41].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5](-[c:10]2[cH:11][c:12]([NH:23][C:24](=[O:25])[c:26]3[cH:27][n:28][cH:29][c:30](-[c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[cH:31]3)[c:13]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[cH:21][cH:22]2)[cH:6][cH:7][cH:8][cH:9]1.[Pd:45]>>[NH2:1][c:4]1[c:5](-[c:10]2[cH:11][c:12]([NH:23][C:24](=[O:25])[c:26]3[cH:27][n:28][cH:29][c:30](-[c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[cH:31]3)[c:13]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[cH:21][cH:22]2)[cH:6][cH:7][cH:8][cH:9]1

Participants

6

Reactant 5

HCID 297MethaneHCID 887MethanolHCID 6212ChloroformHCID 23938PalladiumHCID 58508723Tert-butyl 4-(2-nitrophenyl)-2-(5-phenylpyridine-3-carboxamido)benzoate

Product 1

HCID 58508762Tert-butyl 4-(2-aminophenyl)-2-(5-phenylpyridine-3-carboxamido)benzoate

Sources & evidence

ORD record
ord-7ae53ff5f1cc4880b43fbc4871ae4114
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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