Hydrochloric Acid → HCID 10484722, compound

HRID 142034Notes

Reaction equation

HRID 142034 reaction equation
[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]([CH2:11][CH:12]([C:13](=[O:14])[OH:15])[NH:16][C:17](=[O:18])[N:19]2[CH2:20][CH2:21][CH:22]([N:25]3[C:26](=[O:36])[NH:27][c:28]4[c:29]([cH:32][cH:33][cH:34][cH:35]4)[CH2:30][CH2:31]3)[CH2:23][CH2:24]2)[cH:6][cH:7][c:8]1[CH2:9][CH3:10].[CH3:40][N:41]1[CH:42]2[CH2:43][CH:44]([N:49]3[CH2:50][CH2:51][NH:52][CH2:53][CH2:54]3)[CH2:45][CH:46]1[CH2:47][CH2:48]2.[ClH:37].[ClH:38].[ClH:39]>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]([CH2:11][CH:12]([C:13](=[O:14])[N:52]2[CH2:51][CH2:50][N:49]([CH:44]3[CH2:43][CH:42]4[N:41]([CH3:40])[CH:46]([CH2:45]3)[CH2:47][CH2:48]4)[CH2:54][CH2:53]2)[NH:16][C:17](=[O:18])[N:19]2[CH2:20][CH2:21][CH:22]([N:25]3[C:26](=[O:36])[NH:27][c:28]4[c:29]([cH:32][cH:33][cH:34][cH:35]4)[CH2:30][CH2:31]3)[CH2:23][CH2:24]2)[cH:6][cH:7][c:8]1[CH2:9][CH3:10]

Participants

4

Reactant 3

HCID 313Hydrochloric Acid3×HCID 154797638-Methyl-3-(piperazin-1-yl)-8-azabicyclo[3.2.1]octaneHCID 221845783-(3,4-Diethyl-phenyl)-2-{[4-(2-oxo-1,2,4,5-tetrahydro-1,3-benzodiazepin-3-yl)-piperidine-1-carbonyl]-amino}-propionic acid

Product 1

HCID 10484722HCID 10484722, compound

Sources & evidence

ORD record
ord-c535aa5ca34c45438726cc7ef9002b75
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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