Hydrochloric Acid → Hydrochloric Acid

HRID 1125585Notes

Reaction equation

HRID 1125585 reaction equation
[CH2:40]([OH:41])[CH3:42].[CH3:44][CH2:45][OH:46].[ClH:43].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][N:12]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH:20]3[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]4[c:29](=[O:39])[cH:30][cH:31][c:32]5[n:33][cH:34][c:35]([F:38])[cH:36][c:37]45)[CH2:24][CH2:25]3)[cH:9][c:10]21>>[ClH:43].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][NH:12][CH:20]3[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]4[c:29](=[O:39])[cH:30][cH:31][c:32]5[n:33][cH:34][c:35]([F:38])[cH:36][c:37]45)[CH2:24][CH2:25]3)[cH:9][c:10]21

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 702Ethanol2×HCID 57815262tert-butyl (2,3-dihydro(1,4)dioxino(2,3-c)pyridin-7-ylmethyl)(1-(2-(7-fluoro-2-oxo-1,5-naphthyridin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Product 2

HCID 313Hydrochloric AcidHCID 248667011-(2-(4-((2,3-dihydro(1,4)dioxino(2,3-c)pyridin-7-ylmethyl)amino)piperidin-1-yl)ethyl)-7-fluoro-1,5-naphthyridin-2(1H)-one

Sources & evidence

ORD record
ord-16809312995d48fcbbacd1bda6d51e80
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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