Tetrahydrofuran → 6-(4-(4-amino-3-hydroxyazepan-1-yl)furo[3,2-d]pyrimidin-2-ylamino)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one

HRID 2139992Notes

Reaction equation

HRID 2139992 reaction equation
[CH2:66]([N+:67]([CH2:68][CH2:69][CH2:70][CH3:71])([CH2:72][CH2:73][CH2:74][CH3:75])[CH2:76][CH2:77][CH2:78][CH3:79])[CH2:80][CH2:81][CH3:82].[CH2:83]1[O:84][CH2:85][CH2:86][CH2:87]1.[Cl:40][c:41]1[n:42][c:43]([Cl:44])[c:45]2[o:46][cH:47][cH:48][c:49]2[n:50]1.[F-:65].[NH2:1][CH:2]1[CH:3]([O:32][Si:33]([C:34]([CH3:35])([CH3:36])[CH3:37])([CH3:38])[CH3:39])[CH2:4][N:5]([c:9]2[c:10]3[c:11]([n:12][c:13]([NH:15][c:16]4[cH:17][c:18]5[c:19]([cH:27][cH:28]4)[O:20][C:21]([CH3:25])([CH3:26])[C:22](=[O:24])[NH:23]5)[n:14]2)[cH:29][cH:30][o:31]3)[CH2:6][CH2:7][CH2:8]1.[NH2:51][c:52]1[cH:53][cH:54][c:55]2[c:63]([cH:64]1)[NH:62][C:60](=[O:61])[C:57]([CH3:58])([CH3:59])[O:56]2>>[NH2:1][CH:2]1[CH:3]([OH:32])[CH2:4][N:5]([c:9]2[c:10]3[c:11]([n:12][c:13]([NH:15][c:16]4[cH:17][c:18]5[c:19]([cH:27][cH:28]4)[O:20][C:21]([CH3:25])([CH3:26])[C:22](=[O:24])[NH:23]5)[n:14]2)[cH:29][cH:30][o:31]3)[CH2:6][CH2:7][CH2:8]1

Participants

7

Reactant 6

HCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 136654966-Amino-2,2-dimethyl-2H-benzo[B][1,4]oxazin-3(4H)-oneHCID 457899682,4-Dichlorofuro[3,2-D]pyrimidineHCID 687516286-(4-(4-amino-3-(tert-butyldimethylsilyloxy)azepan-1-yl)furo[3,2-d]pyrimidin-2-ylamino)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one

Product 1

HCID 687531326-(4-(4-amino-3-hydroxyazepan-1-yl)furo[3,2-d]pyrimidin-2-ylamino)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one

Sources & evidence

ORD record
ord-1e823bb32ca5466fbe69eb7dccd80cbe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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