Ammonium → (4-Amino-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-nitro-phenyl)methanone

HRID 1558492Notes

Reaction equation

HRID 1558492 reaction equation
[CH2:29]1[O:30][CH2:31][CH2:32][O:33][CH2:34]1.[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:22]1[CH2:23][CH2:24][CH2:25][CH2:26]1)[cH:9][c:10]2[C:11](=[O:12])[c:13]1[cH:14][c:15]([N+:19](=[O:20])[O-:21])[cH:16][cH:17][cH:18]1.[NH4+:28].[OH-:27]>>[c:2]1([NH2:28])[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:22]1[CH2:23][CH2:24][CH2:25][CH2:26]1)[cH:9][c:10]2[C:11](=[O:12])[c:13]1[cH:14][c:15]([N+:19](=[O:20])[O-:21])[cH:16][cH:17][cH:18]1

Participants

5

Reactant 4

HCID 223AmmoniumHCID 961HydroxideHCID 312751,4-DioxaneHCID 86760547(4-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-nitro-phenyl)-methanone

Product 1

HCID 11859043(4-Amino-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-nitro-phenyl)methanone

Sources & evidence

ORD record
ord-c90c0ac57d244874becfa6069280b810
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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