Methylamine → (3aSR,10RS)-6-(1,1-Difluoro-methoxy)-10-(3-hydroxy-phenyl)-3a-methyl-2-(2-methylaminoethyl)-3a,4,9,10-tetrahydro-2,9,10a-triaza-cyclopenta[b]fluorene-1,3-dione

HRID 2334871Notes

Reaction equation

HRID 2334871 reaction equation
[Br:1][CH2:2][CH2:3][N:4]1[C:5](=[O:33])[C:6]2([CH3:32])[N:7]([CH:8]([c:23]3[cH:24][c:25]([OH:29])[cH:26][cH:27][cH:28]3)[c:9]3[nH:10][c:11]4[cH:12][cH:13][c:14]([O:19][CH:20]([F:21])[F:22])[cH:15][c:16]4[c:17]3[CH2:18]2)[C:30]1=[O:31].[CH3:34][NH2:35].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1>>[CH2:2]([CH2:3][N:4]1[C:5](=[O:33])[C:6]2([CH3:32])[N:7]([CH:8]([c:23]3[cH:24][c:25]([OH:29])[cH:26][cH:27][cH:28]3)[c:9]3[nH:10][c:11]4[cH:12][cH:13][c:14]([O:19][CH:20]([F:21])[F:22])[cH:15][c:16]4[c:17]3[CH2:18]2)[C:30]1=[O:31])[NH:35][CH3:34]

Participants

4

Reactant 3

HCID 6329MethylamineHCID 8028TetrahydrofuranHCID 68939720(3aSR,10RS)-2-(2-Bromoethyl)-6-(1,1-difluoro-methoxy)-10-(3-hydroxy-phenyl)-3a-methyl-3a,4,9,10-tetrahydro-2,9,10a-triaza-cyclopenta[b]fluorene-1,3-dione

Product 1

HCID 68944341(3aSR,10RS)-6-(1,1-Difluoro-methoxy)-10-(3-hydroxy-phenyl)-3a-methyl-2-(2-methylaminoethyl)-3a,4,9,10-tetrahydro-2,9,10a-triaza-cyclopenta[b]fluorene-1,3-dione

Sources & evidence

ORD record
ord-8ebba2087d37406d84fad408baf6bf19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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