Tetrahydrofuran → trans-[4-(4-Cyano-phenoxy)-cyclohexyl]-(4-isopropyl-piperazin-1-yl)-methanone

HRID 1112822Notes

Reaction equation

HRID 1112822 reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[CH:12]2[CH2:13][CH2:14][CH:15]([OH:18])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1.[N:28]([C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])=[N:36][C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43].[OH:19][c:20]1[cH:21][cH:22][c:23]([C:26]#[N:27])[cH:24][cH:25]1>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[CH:12]2[CH2:13][CH2:14][CH:15]([O:18][c:20]3[cH:21][cH:22][c:23]([C:26]#[N:27])[cH:24][cH:25]3)[CH2:16][CH2:17]2)[CH2:8][CH2:9]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 130194-CyanophenolHCID 97268Di-tert-butyl azodicarboxylateHCID 57538855cis-(4-Isopropyl-piperazin-1-yl)-(4-hydroxycyclohexyl)-methanone

Product 1

HCID 68443309trans-[4-(4-Cyano-phenoxy)-cyclohexyl]-(4-isopropyl-piperazin-1-yl)-methanone

Sources & evidence

ORD record
ord-0dacc22f772c4193a81fc35fcd2ead73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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