2-(propan-2-yl)-1H-1,3-benzodiazole → HCID 59605264, compound

HRID 686815Notes

Reaction equation

HRID 686815 reaction equation
[CH:1]([CH3:2])([CH3:3])[c:4]1[nH:5][c:6]2[c:7]([n:8]1)[cH:9][cH:10][cH:11][cH:12]2.[Cl:13][c:14]1[n:15][c:16]([N:35]2[CH2:36][CH2:37][O:38][CH2:39][CH2:40]2)[c:17]2[n:18][c:19]([CH2:24][N:25]3[CH2:26][CH2:27][CH:28]([C:31]([CH3:32])([CH3:33])[OH:34])[CH2:29][CH2:30]3)[n:20]([CH3:23])[c:21]2[n:22]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5](-[c:14]2[n:15][c:16]([N:35]3[CH2:36][CH2:37][O:38][CH2:39][CH2:40]3)[c:17]3[n:18][c:19]([CH2:24][N:25]4[CH2:26][CH2:27][CH:28]([C:31]([CH3:32])([CH3:33])[OH:34])[CH2:29][CH2:30]4)[n:20]([CH3:23])[c:21]3[n:22]2)[c:6]2[c:7]([n:8]1)[cH:9][cH:10][cH:11][cH:12]2

Participants

3

Reactant 2

HCID 221212-(propan-2-yl)-1H-1,3-benzodiazoleHCID 596034262-(1-((2-chloro-9-methyl-6-morpholino-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol

Product 1

HCID 59605264HCID 59605264, compound

Sources & evidence

ORD record
ord-44a9ecb14e604c94b246d54656e2bb28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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