1-Butanol → HCID 178495565, compound

HRID 2348777Notes

Reaction equation

HRID 2348777 reaction equation
[Br:1][c:2]1[c:3]([F:18])[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12]([CH:13]([CH3:14])[O:15][CH3:16])=[O:17].[CH2:41]([OH:42])[CH2:43][CH2:44][CH3:45].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[NH:19]1[CH2:20][CH:21]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH2:22][CH2:23]1>>[Br:1][c:2]1[c:3]([N:19]2[CH2:20][CH:21]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH2:22][CH2:23]2)[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12]([CH:13]([CH3:14])[O:15][CH3:16])=[O:17]

Participants

5

Reactant 4

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 2757234tert-butyl N-(pyrrolidin-3-yl)carbamateHCID 67045076N-(5-bromo-4-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-methoxypropanamide

Product 1

HCID 178495565HCID 178495565, compound

Sources & evidence

ORD record
ord-ff1ea67189af4f4fa73010a1a694aff1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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