Acetate → 7-Benzyl-4-(pyridin-2-yl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

HRID 308515Notes

Reaction equation

HRID 308515 reaction equation
[CH2:19]([Sn:20]([CH2:21][CH2:22][CH2:23][CH3:30])([c:24]1[n:25][cH:26][cH:27][cH:28][cH:29]1)[CH2:31][CH2:32][CH2:33][CH3:34])[CH2:35][CH2:36][CH3:37].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][c:10]2[n:11][cH:12][n:13][c:14]([Cl:18])[c:15]2[CH2:16][CH2:17]1.[CH2:54]1[O:55][CH2:56][CH2:57][O:58][CH2:59]1.[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[O-:68][C:69]([CH3:70])=[O:71].[O-:72][C:73]([CH3:74])=[O:75].[OH2:60].[Pd+2:67].[o:38]1[cH:39][cH:40][cH:41][c:42]1[P:43]([c:44]1[o:45][cH:46][cH:47][cH:48]1)[c:49]1[o:50][cH:51][cH:52][cH:53]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][c:10]2[n:11][cH:12][n:13][c:14](-[c:24]3[n:25][cH:26][cH:27][cH:28][cH:29]3)[c:15]2[CH2:16][CH2:17]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 521585Tris(furan-2-yl)phosphaneHCID 6077842-(Tributylstannyl)pyridineHCID 219588387-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

Product 1

HCID 670726517-Benzyl-4-(pyridin-2-yl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

Sources & evidence

ORD record
ord-24e768d7f7444d2cb64ff874f5b7fb10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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