Hydrochloric Acid → HCID 67385302, compound

HRID 306484Notes

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.[ClH:50].[ClH:51].[n:52]1[c:53]([N:58]2[CH2:59][CH2:60][NH:61][CH2:62][CH2:63]2)[n:54][cH:55][cH:56][cH:57]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:35])[N:61]5[CH2:60][CH2:59][N:58]([c:53]6[n:52][cH:57][cH:56][cH:55][n:54]6)[CH2:63][CH2:62]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

Participants

Reactant 3

HCID 313Hydrochloric Acid2×

HCID 887471-(2-Pyrimidinyl)piperazine

HCID 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 67385302HCID 67385302, compound

Sources & evidence

ORD record: ord-64f510168c004c389a4c1ad058ae14d1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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