Hydrochloric Acid → Ethyl 3-[[2-[6-cyclopropyl-2-oxo-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-ylmethylamino)-1-pyridinyl]acetyl]amino]-3-(3-fluorophenyl)propanoate

HRID 314687Notes

Reaction equation

HRID 314687 reaction equation
[CH:1]1([c:4]2[cH:5][cH:6][c:7]([NH:15][CH2:16][c:17]3[n:18][c:19]4[c:24]([cH:25][cH:26]3)[CH2:23][CH2:22][CH2:21][NH:20]4)[c:8](=[O:14])[n:9]2[CH2:10][C:11](=[O:12])[OH:13])[CH2:2][CH2:3]1.[ClH:27].[NH2:28][CH:29]([CH2:30][C:31](=[O:32])[O:33][CH2:34][CH3:35])[c:36]1[cH:37][c:38]([F:42])[cH:39][cH:40][cH:41]1>>[CH:1]1([c:4]2[cH:5][cH:6][c:7]([NH:15][CH2:16][c:17]3[n:18][c:19]4[c:24]([cH:25][cH:26]3)[CH2:23][CH2:22][CH2:21][NH:20]4)[c:8](=[O:14])[n:9]2[CH2:10][C:11](=[O:12])[NH:28][CH:29]([CH2:30][C:31](=[O:32])[O:33][CH2:34][CH3:35])[c:36]2[cH:37][c:38]([F:42])[cH:39][cH:40][cH:41]2)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 5151020Ethyl 3-amino-3-(3-fluorophenyl)propanoateHCID 22008804{6-Cyclopropyl-2-oxo-3-[(5,6,7,8-tetrahydro-[1,8]naphthyridin-2-ylmethyl)-amino]-2H-pyridin-1-yl}-acetic acid

Product 1

HCID 70224140Ethyl 3-[[2-[6-cyclopropyl-2-oxo-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-ylmethylamino)-1-pyridinyl]acetyl]amino]-3-(3-fluorophenyl)propanoate

Sources & evidence

ORD record
ord-9199f78c414b4e04838b62bb5bc930d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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