Isopropanol → HCID 66898703, compound

HRID 1126776Notes

Reaction equation

[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH:12]12[CH2:13][NH:14][CH2:15][CH:16]([CH2:17][CH2:18]1)[N:19]2[C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26].[CH:34]([OH:35])([CH3:36])[CH3:37].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[nH:8][cH:9][c:10]2[CH3:11]>>[c:2]1([N:14]2[CH2:13][CH:12]3[CH2:18][CH2:17][CH:16]([CH2:15]2)[N:19]3[C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[c:3]2[c:4]([n:5][cH:6][n:7]1)[nH:8][cH:9][c:10]2[CH3:11]

Participants

Reactant 4

HCID 3776Isopropanol

HCID 8471Triethylamine

HCID 148092824-Chloro-5-methyl-7H-pyrrolo(2,3-d)pyrimidine

HCID 157409088-Boc-3,8-diaza-bicyclo(3.2.1)octane

Product 1

HCID 66898703HCID 66898703, compound

Sources & evidence

ORD record: ord-816dbbf474f94e1cb584fe924beed684
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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