Hydroxide → 3-[6-(4-Amino-2-fluorophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methylurea

HRID 1223231Notes

Reaction equation

HRID 1223231 reaction equation
[C+4:39].[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([NH:11][C:12]([N:13]([CH3:14])[CH:15]3[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[CH2:19][CH2:20]3)=[O:26])[n:8][cH:9][n:10]2)[cH:27][cH:28][c:29]([N+:31]([O-:32])=[O:33])[cH:30]1.[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH-:40].[OH-:42].[OH-:43].[OH-:44].[OH-:45].[OH-:46].[Pd+2:41]>>[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([NH:11][C:12]([N:13]([CH3:14])[CH:15]3[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[CH2:19][CH2:20]3)=[O:26])[n:8][cH:9][n:10]2)[cH:27][cH:28][c:29]([NH2:31])[cH:30]1

Participants

6

Reactant 5

HCID 961Hydroxide6×HCID 8028TetrahydrofuranHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 231532113-[6-(2-Fluoro-4-nitrophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methylureaHCID 178420935HCID 178420935, compound

Product 1

HCID 231530283-[6-(4-Amino-2-fluorophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methylurea

Sources & evidence

ORD record
ord-93c57588f22b43f8a99fa0ff96ba258e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…