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1-Isopropylpiperazine → {4-[4-{2-[Bis-(4-methoxy-benzyl)-amino]-pyrimidin-5-yl}-2-morpholin-4-yl-5,6-dihydro-pyrrolo[2,3-d]pyrimidin-7-yl]-phenyl}-(4-isopropyl-piperazin-1-yl)-methanone

HRID 94512
Notes
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Reaction equation

HRID 94512 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][cH:11][c:12](-[c:15]3[c:16]4[c:17]([n:18][c:19]([N:21]5[CH2:22][CH2:23][O:24][CH2:25][CH2:26]5)[n:20]3)[N:27]([c:30]3[cH:31][cH:32][c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38]3)[CH2:28][CH2:29]4)[cH:13][n:14]2)[CH2:39][c:40]2[cH:41][cH:42][c:43]([O:46][CH3:47])[cH:44][cH:45]2)[cH:48][cH:49]1.[CH:50]([CH3:51])([CH3:52])[N:53]1[CH2:54][CH2:55][NH:56][CH2:57][CH2:58]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][cH:11][c:12](-[c:15]3[c:16]4[c:17]([n:18][c:19]([N:21]5[CH2:22][CH2:23][O:24][CH2:25][CH2:26]5)[n:20]3)[N:27]([c:30]3[cH:31][cH:32][c:33]([C:34](=[O:36])[N:56]5[CH2:55][CH2:54][N:53]([CH:50]([CH3:51])[CH3:52])[CH2:58][CH2:57]5)[cH:37][cH:38]3)[CH2:28][CH2:29]4)[cH:13][n:14]2)[CH2:39][c:40]2[cH:41][cH:42][c:43]([O:46][CH3:47])[cH:44][cH:45]2)[cH:48][cH:49]1
ParticipantsSources & evidenceReaction notes

Participants

3

Reactant 2

HCID 780131-IsopropylpiperazineHCID 592448874-(4-{2-[Bis-(4-methoxy-benzyl)-amino]-pyrimidin-5-yl}-2-morpholin-4-yl-5,6-dihydro-pyrrolo[2,3-d]pyrimidine-7-yl)-benzoic acid

Product 1

HCID 67386052{4-[4-{2-[Bis-(4-methoxy-benzyl)-amino]-pyrimidin-5-yl}-2-morpholin-4-yl-5,6-dihydro-pyrrolo[2,3-d]pyrimidin-7-yl]-phenyl}-(4-isopropyl-piperazin-1-yl)-methanone

Sources & evidence

ORD record
ord-701b628ddccc4ba5a5266288e39a3cc5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes