Isopropanol → HCID 20816979, compound

HRID 113124Notes

Reaction equation

HRID 113124 reaction equation
[CH2:33]1[O:34][CH:35]1[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH:42]([OH:43])([CH3:44])[CH3:45].[NH2:1][c:2]1[c:3]([O:31][CH3:32])[cH:4][c:5](-[c:8]2[n:9][n:10]([CH:18]3[CH2:19][CH2:20][CH:21]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[CH2:22][CH2:23]3)[c:11]3[n:12][cH:13][n:14][c:15]([NH2:17])[c:16]23)[cH:6][cH:7]1>>[NH:1]([c:2]1[c:3]([O:31][CH3:32])[cH:4][c:5](-[c:8]2[n:9][n:10]([CH:18]3[CH2:19][CH2:20][CH:21]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[CH2:22][CH2:23]3)[c:11]3[n:12][cH:13][n:14][c:15]([NH2:17])[c:16]23)[cH:6][cH:7]1)[CH:35]([CH2:33][OH:34])[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 7276Styrene OxideHCID 208170343-(4-amino-3-methoxyphenyl)-1-[4-(4-methylpiperazino)-cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Product 1

HCID 20816979HCID 20816979, compound

Sources & evidence

ORD record
ord-cd0ab3911742466ba67179211b0d0441
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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