Pyridine → N1-{4-[4-amino-7-(4-oxocyclohexyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxyphenyl}-3-phenylpropanamide

HRID 2313338Notes

Reaction equation

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

Participants

Reactant 4

HCID 1049Pyridine

HCID 6344Dichloromethane

HCID 64801Benzenepropanoyl chloride

HCID 227363904-[4-amino-5-(4-amino-3-methoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]-1-cyclohexanone

Product 1

HCID 22736194N1-{4-[4-amino-7-(4-oxocyclohexyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxyphenyl}-3-phenylpropanamide

Sources & evidence

ORD record: ord-18820b2b5d5640cdacddfb4ee209fbfd
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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