Dimethylformamide → 2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-(1-methylpiperidin-4-yl)acetamide

HRID 87472

Reaction equation

HRID 87472 reaction equation
[CH3:74][N:75]1[CH2:76][CH2:77][CH:78]([NH2:81])[CH2:79][CH2:80]1.[CH:65]([N:66]([CH2:67][CH3:68])[CH:69]([CH3:70])[CH3:71])([CH3:72])[CH3:73].[Cl:82][CH2:83][Cl:84].[O:85]=[CH:86][N:87]([CH3:88])[CH3:89].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][P+:41]([N:42]2[CH2:43][CH2:44][CH2:45][CH2:46]2)([N:47]2[CH2:48][CH2:49][CH2:50][CH2:51]2)[N:52]2[CH2:53][CH2:54][CH2:55][CH2:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1.[nH:1]1[n:2][cH:3][c:4]2[cH:5][c:6]([NH:10][c:11]3[n:12][c:13](-[c:21]4[cH:22][c:23]([O:24][CH2:25][C:26](=[O:27])[OH:28])[cH:29][cH:30][cH:31]4)[n:14][c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]34)[cH:7][cH:8][c:9]12>>[nH:1]1[n:2][cH:3][c:4]2[cH:5][c:6]([NH:10][c:11]3[n:12][c:13](-[c:21]4[cH:22][c:23]([O:24][CH2:25][C:26](=[O:27])[NH:81][CH:78]5[CH2:77][CH2:76][N:75]([CH3:74])[CH2:80][CH2:79]5)[cH:29][cH:30][cH:31]4)[n:14][c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]34)[cH:7][cH:8][c:9]12

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphoniumHCID 27375314-Amino-1-methylpiperidineHCID 593619882-(3-(4-((1H-indazol-5-yl)amino)quinazolin-2-yl)phenoxy)acetic acid

Product 1

HCID 593619012-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-(1-methylpiperidin-4-yl)acetamide

Sources & evidence

ORD record
ord-b85798436a1f4342913a8df85281f310
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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