Acetate → HCID 67521840, compound

HRID 2141264Notes

Reaction equation

HRID 2141264 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([n:14]2[n:15][cH:16][c:17](-[c:19]3[cH:20][n:21][c:22]([NH2:34])[c:23]([B:25]4[O:26][C:27]([CH3:28])([CH3:29])[C:30]([CH3:31])([CH3:32])[O:33]4)[cH:24]3)[cH:18]2)[CH2:12][CH2:13]1.[CH3:46][C:47](=[O:48])[O-:49].[Cl:35][c:36]1[c:37]2[c:42]([cH:43][cH:44][cH:45]1)[CH2:41][NH:40][CH2:39][CH2:38]2.[Cl:56][CH2:57][Cl:58].[cH:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([n:14]2[n:15][cH:16][c:17](-[c:19]3[cH:20][n:21][c:22]([NH2:34])[c:23]([N:40]4[CH2:39][CH2:38][c:37]5[c:36]([Cl:35])[cH:45][cH:44][cH:43][c:42]5[CH2:41]4)[cH:24]3)[cH:18]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 175AcetateHCID 1049PyridineHCID 6344DichloromethaneHCID 125950835-Chloro-1,2,3,4-tetrahydroisoquinolineHCID 534879604-[4-[6-Amino-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-3-yl]pyrazol-1-yl]piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 67521840HCID 67521840, compound

Sources & evidence

ORD record
ord-ab137ba339a149f8a9f469b3057abf45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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