Water → HCID 10091415, compound

HRID 686617Notes

Reaction equation

HRID 686617 reaction equation
[C:23]([CH3:24])([CH3:25])([CH3:26])[O:27][C:28](=[O:29])[N:30]1[CH:31]2[CH2:32][NH:33][CH:34]([CH2:35]1)[CH2:36]2.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:8][c:9]1[n:10]([CH3:22])[c:11](=[O:21])[cH:12][c:13](-[c:15]2[n:16][cH:17][n:18][cH:19][cH:20]2)[n:14]1.[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH2:37]>>[c:9]1([N:33]2[CH2:32][CH:31]3[N:30]([C:28]([O:27][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:29])[CH2:35][CH:34]2[CH2:36]3)[n:10]([CH3:22])[c:11](=[O:21])[cH:12][c:13](-[c:15]2[n:16][cH:17][n:18][cH:19][cH:20]2)[n:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylateHCID 179544602-Chloro-3-methyl-6-(pyrimidin-4-YL)pyrimidin-4-one

Product 1

HCID 10091415HCID 10091415, compound

Sources & evidence

ORD record
ord-6dbc30882efe48f583c8d0a1a84e3bcc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…