Toluene → HCID 68782157, compound

HRID 2336323Notes

Reaction equation

HRID 2336323 reaction equation
[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27](=[O:28])[N:29]1[CH2:30][CH2:31][CH:32]([NH2:35])[CH2:33][CH2:34]1.[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:1][c:2]1[n:3][c:4]2[cH:5][c:6]([O:20][CH3:21])[c:7]([O:18][CH3:19])[cH:8][c:9]2[c:10]([N:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[n:11]1.[O:45]=[C:46]([CH:47]=[CH:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[O:63]=[C:64]([CH:65]=[CH:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)[CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1.[O:81]=[C:82]([CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)[CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1.[Pd:43].[Pd:44]>>[c:2]1([NH:35][CH:32]2[CH2:31][CH2:30][N:29]([C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:28])[CH2:34][CH2:33]2)[n:3][c:4]2[cH:5][c:6]([O:20][CH3:21])[c:7]([O:18][CH3:19])[cH:8][c:9]2[c:10]([N:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[n:11]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 12682914-Amino-1-Boc-piperidineHCID 17135152-chloro-6,7-dimethoxy-4-piperidin-1-ylquinazoline

Product 1

HCID 68782157HCID 68782157, compound

Sources & evidence

ORD record
ord-17bd96e234234831a849a48097948946
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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