Acetic Acid → HCID 178508138, compound

HRID 1141946Notes

Reaction equation

HRID 1141946 reaction equation
[BH3:30].[CH3:36][C:37](=[O:38])[OH:39].[CH3:40][OH:41].[NH2:1][CH:2]1[CH:3]([C:9](=[O:10])[N:11]2[CH2:12][CH:13]([CH2:17][c:18]3[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]3)[CH2:14][CH2:15][CH2:16]2)[CH2:4][S:5](=[O:7])(=[O:8])[CH2:6]1.[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1>>[NH2:1][CH:2]1[CH:3]([CH2:9][N:11]2[CH2:12][CH:13]([CH2:17][c:18]3[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]3)[CH2:14][CH2:15][CH2:16]2)[CH2:4][S:5](=[O:7])(=[O:8])[CH2:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 6331BoraneHCID 8028Tetrahydrofuran2×HCID 178508139(4-amino-1,1-dioxothiolan-3-yl)-[3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone

Product 1

HCID 178508138HCID 178508138, compound

Sources & evidence

ORD record
ord-cfd31f7d52f14b9ab2a8dda87d1b094c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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