2-(3-Fluorophenyl)ethanamine → HCID 67045593, compound

HRID 138199Notes

Reaction equation

HRID 138199 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH3:28])[N:11]([CH2:14][c:15]2[cH:16][c:17](-[c:21]3[n:22][c:23]([Cl:27])[n:24][cH:25][cH:26]3)[cH:18][cH:19][cH:20]2)[CH2:12][CH2:13]1.[F:29][c:30]1[cH:31][c:32]([CH2:33][CH2:34][NH2:35])[cH:36][cH:37][cH:38]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH3:28])[N:11]([CH2:14][c:15]2[cH:16][c:17](-[c:21]3[n:22][c:23]([NH:35][CH2:34][CH2:33][c:32]4[cH:31][c:30]([F:29])[cH:38][cH:37][cH:36]4)[n:24][cH:25][cH:26]3)[cH:18][cH:19][cH:20]2)[CH2:12][CH2:13]1

Participants

3

Reactant 2

HCID 5339282-(3-Fluorophenyl)ethanamineHCID 866033054-[3-(2-Chloro-pyrimidin-4-yl)-benzyl]-3-methyl-piperazine-1-carboxylic acid tert-butyl ester

Product 1

HCID 67045593HCID 67045593, compound

Sources & evidence

ORD record
ord-90905be88bc04cbfa6c6c2ca095da47f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…