Hydrochloric Acid → HCID 178492694, compound

HRID 1539990Notes

Reaction equation

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

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 887Methanol

HCID 312751,4-Dioxane

HCID 183548723-methoxy-4-(2-methoxy-1H-benzimidazol-4-yl)carbonylamino-N-methyl-N-[4-methyl-2-[5-(4-methylpiperazin-1-yl)carbonylpent-1-yloxy]phenyl]benzamide

Product 1

HCID 178492694HCID 178492694, compound

Sources & evidence

ORD record: ord-5c344e15cb05498fb2012073a024db1c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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