Dichloromethane → N4-[3-Methyl-4-(6-methylpyridin-3-yloxy)-phenyl]-N6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]oxazol-2-yl)-quinazoline-4,6-diamine

HRID 202166Notes

Reaction equation

HRID 202166 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]2[N:11]=[C:12]([NH:16][c:17]3[cH:18][c:19]4[c:20]([NH:27][c:28]5[cH:29][c:30]([CH3:42])[c:31]([O:34][c:35]6[cH:36][n:37][c:38]([CH3:41])[cH:39][cH:40]6)[cH:32][cH:33]5)[n:21][cH:22][n:23][c:24]4[cH:25][cH:26]3)[O:13][CH:14]2[CH2:15]1)([CH3:5])([CH3:6])[CH3:7].[CH2:50]([Cl:51])[Cl:52].[F:43][C:44]([F:45])([F:46])[C:47]([OH:48])=[O:49]>>[NH:8]1[CH2:9][CH:10]2[N:11]=[C:12]([NH:16][c:17]3[cH:18][c:19]4[c:20]([NH:27][c:28]5[cH:29][c:30]([CH3:42])[c:31]([O:34][c:35]6[cH:36][n:37][c:38]([CH3:41])[cH:39][cH:40]6)[cH:32][cH:33]5)[n:21][cH:22][n:23][c:24]4[cH:25][cH:26]3)[O:13][CH:14]2[CH2:15]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 116426392-{4-[3-Methyl-4-(6-methylpyridin-3-yloxy)-phenylamino]-quinazolin-6-ylamino}-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazole-5-carboxylic acid tert-butyl ester

Product 1

HCID 11677093N4-[3-Methyl-4-(6-methylpyridin-3-yloxy)-phenyl]-N6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]oxazol-2-yl)-quinazoline-4,6-diamine

Sources & evidence

ORD record
ord-a8200982d00b46d9bac73b79afb424be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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