Ethanol → 2-[4-[[3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-ethylpiperidin-4-yl)-3H-pyrrolo[3,4-f]benzimidazole-5,7-dione

HRID 942670Notes

Reaction equation

HRID 942670 reaction equation
[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:52][CH2:53][OH:54].[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[cH:12][c:13]4[c:17]([cH:18][c:19]3[n:20]2)[C:16](=[O:21])[N:15]([CH:22]2[CH2:23][CH2:24][N:25]([CH2:28][CH3:29])[CH2:26][CH2:27]2)[C:14]4=[O:30])[c:4](=[O:8])[nH:5][cH:6][cH:7]1.[NH2:31][CH2:32][CH:33]([CH2:34][O:35][c:36]1[c:37]([CH3:43])[cH:38][c:39]([CH3:42])[cH:40][cH:41]1)[OH:44]>>[c:2]1([NH:31][CH2:32][CH:33]([CH2:34][O:35][c:36]2[c:37]([CH3:43])[cH:38][c:39]([CH3:42])[cH:40][cH:41]2)[OH:44])[c:3](-[c:9]2[nH:10][c:11]3[cH:12][c:13]4[c:17]([cH:18][c:19]3[n:20]2)[C:16](=[O:21])[N:15]([CH:22]2[CH2:23][CH2:24][N:25]([CH2:28][CH3:29])[CH2:26][CH2:27]2)[C:14]4=[O:30])[c:4](=[O:8])[nH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8471TriethylamineHCID 33871311-Amino-3-(2,4-dimethylphenoxy)propan-2-olHCID 1362003492-(4-chloro-2-oxo-1,2-dihydro-pyridin-3-yl)-6-(1-ethyl-piperidin-4-yl)-1H-1,3,6-triaza-s-indacene-5,7-dione

Product 1

HCID 1363511442-[4-[[3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-ethylpiperidin-4-yl)-3H-pyrrolo[3,4-f]benzimidazole-5,7-dione

Sources & evidence

ORD record
ord-93dd979d67ac4c2fba177e51b2f3efeb
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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