Methanol → N2-(2-amino-ethyl)-N4-(4-methoxy-phenyl)-N4-methyl-quinazoline-2,4-diamine

HRID 313470Notes

Reaction equation

HRID 313470 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][CH2:9][NH:10][c:11]1[n:12][c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]2[c:19]([N:21]([CH3:22])[c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[n:20]1)([CH3:5])([CH3:6])[CH3:31].[C:53]([O:54][C:55](=[O:56])[NH:57][CH2:58][CH2:59][NH2:60])([CH3:61])([CH3:62])[CH3:63].[CH3:64][CH2:65][N:66]([CH2:67][CH3:68])[CH2:69][CH3:70].[CH3:78][OH:79].[CH:71]([OH:72])([CH3:73])[CH3:74].[Cl:32][c:33]1[n:34][c:35]([N:36]([c:37]2[cH:38][cH:39][c:40]([O:41][CH3:42])[cH:43][cH:44]2)[CH3:45])[c:46]2[c:47]([cH:48][cH:49][cH:50][cH:51]2)[n:52]1.[Cl:75][CH2:76][Cl:77].[Cl:80][CH2:81][Cl:82]>>[NH2:7][CH2:8][CH2:9][NH:10][c:11]1[n:12][c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]2[c:19]([N:21]([CH3:22])[c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[n:20]1

Participants

8

Reactant 7

HCID 887MethanolHCID 3776IsopropanolHCID 6344Dichloromethane2×HCID 8471TriethylamineHCID 187201N-BOC-ethylenediamineHCID 117381122-chloro-N-(4-methoxyphenyl)-N-methylquinazolin-4-amineHCID 59237304(2-{4-[(4-Methoxy-phenyl)-methyl-amino]-quinazolin-2-ylamino}-ethyl)-carbamic acid tert-butyl ester

Product 1

HCID 59242058N2-(2-amino-ethyl)-N4-(4-methoxy-phenyl)-N4-methyl-quinazoline-2,4-diamine

Sources & evidence

ORD record
ord-e27c3bfcb7634219bd17ec110a647e9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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