1,2-Dichloroethane → 5-[4-(2-morpholinomethylphenoxy)phenyl]-7-(3-tetrahydrofuryl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine

HRID 92756Notes

Reaction equation

HRID 92756 reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[C:51](=[O:52])([OH:53])[O-:54].[C:56]([O:57][CH2:58][CH3:59])(=[O:60])[CH3:61].[CH2:31]1[CH2:32][O:33][CH2:34][CH2:35][NH:36]1.[CH2:62]([O:63][CH2:64][CH3:65])[CH3:66].[Cl:67][CH2:68][CH2:69][Cl:70].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:26]1[CH2:27][O:28][CH2:29][CH2:30]1)[cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:15][c:16]2[c:17]([CH:18]=[O:19])[cH:20][cH:21][cH:22][cH:23]2)[cH:24][cH:25]1.[Na+:50].[Na+:55]>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:26]1[CH2:27][O:28][CH2:29][CH2:30]1)[cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:15][c:16]2[c:17]([CH2:18][N:36]3[CH2:31][CH2:32][O:33][CH2:34][CH2:35]3)[cH:20][cH:21][cH:22][cH:23]2)[cH:24][cH:25]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 3283Diethyl EtherHCID 8083MorpholineHCID 8857Ethyl AcetateHCID 2724942TriacetoxyborohydrideHCID 865890032-[4-(4-amino-7-(3-tetrahydrofuryl)-7H-pyrrolo[2,3-d)pyrimidin-5-yl)phenoxy]benzaldehyde

Product 1

HCID 227363765-[4-(2-morpholinomethylphenoxy)phenyl]-7-(3-tetrahydrofuryl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine

Sources & evidence

ORD record
ord-c1af45e5947b492ba198da09358be704
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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