Dichloromethane → tert-butyl N-[2-[2-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]quinazolin-5-yl]oxypropylamino]-2-oxoethyl]-N-methylcarbamate

HRID 183020Notes

Reaction equation

HRID 183020 reaction equation
[C:41]([CH3:42])([CH3:43])([CH3:44])[O:45][C:46](=[O:47])[N:48]([CH3:49])[CH2:50][C:51](=[O:52])[OH:53].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[Cl:78][CH2:79][Cl:80].[NH2:1][CH2:2][CH:3]([O:4][c:5]1[c:6]2[c:7]([NH:15][c:16]3[cH:17][c:18]([Cl:30])[c:19]([O:22][CH2:23][c:24]4[n:25][cH:26][cH:27][cH:28][cH:29]4)[cH:20][cH:21]3)[n:8][cH:9][n:10][c:11]2[cH:12][cH:13][cH:14]1)[CH3:31].[P-:54]([F:55])([F:56])([F:57])([F:58])([F:59])[F:60].[n:61]1([O:62][C:63]([N:64]([CH3:65])[CH3:66])=[N+:67]([CH3:68])[CH3:69])[c:70]2[n:71][cH:72][cH:73][cH:74][c:75]2[n:76][n:77]1>>[NH:1]([CH2:2][CH:3]([O:4][c:5]1[c:6]2[c:7]([NH:15][c:16]3[cH:17][c:18]([Cl:30])[c:19]([O:22][CH2:23][c:24]4[n:25][cH:26][cH:27][cH:28][cH:29]4)[cH:20][cH:21]3)[n:8][cH:9][n:10][c:11]2[cH:12][cH:13][cH:14]1)[CH3:31])[C:51]([CH2:50][N:48]([C:46]([O:45][C:41]([CH3:42])([CH3:43])[CH3:44])=[O:47])[CH3:49])=[O:52]

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 83692Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 775965805-(1-aminopropan-2-yloxy)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine

Product 1

HCID 76678968tert-butyl N-[2-[2-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]quinazolin-5-yl]oxypropylamino]-2-oxoethyl]-N-methylcarbamate

Sources & evidence

ORD record
ord-b0c56113ad1c44c4acd5c248f0f0101a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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