1-(Piperidin-4-yl)-1,3-diazinan-2-one → HCID 70160348, compound

HRID 840419Notes

Reaction equation

HRID 840419 reaction equation
[O:1]=[C:2]1[NH:7][CH2:6][CH2:5][CH2:4][N:3]1[CH:8]1[CH2:13][CH2:12][NH:11][CH2:10][CH2:9]1.[C:14]([OH:26])(=[O:25])[CH2:15][C:16]([CH2:21][C:22]([OH:24])=[O:23])([C:18]([OH:20])=[O:19])[OH:17].[Cl:27][C:28]1[CH:33]=[CH:32][C:31]([CH:34]([CH2:53][CH2:54]N2CCC(C3C=CC=CC=3[S@](C)=O)CC2)[CH2:35][N:36]([CH3:52])[C:37]([C:39]2[C:48]3[C:43](=[CH:44][CH:45]=[CH:46][CH:47]=3)[CH:42]=[C:41]([N+:49]([O-:51])=[O:50])[CH:40]=2)=[O:38])=[CH:30][CH:29]=1>O>[C:14]([OH:26])(=[O:25])[CH2:15][C:16]([CH2:21][C:22]([OH:24])=[O:23])([C:18]([OH:20])=[O:19])[OH:17].[Cl:27][C:28]1[CH:29]=[CH:30][C:31]([CH:34]([CH2:53][CH2:54][N:11]2[CH2:12][CH2:13][CH:8]([N:3]3[CH2:4][CH2:5][CH2:6][NH:7][C:2]3=[O:1])[CH2:9][CH2:10]2)[CH2:35][N:36]([CH3:52])[C:37]([C:39]2[C:48]3[C:43](=[CH:44][CH:45]=[CH:46][CH:47]=3)[CH:42]=[C:41]([N+:49]([O-:51])=[O:50])[CH:40]=2)=[O:38])=[CH:32][CH:33]=1

Participants

4

Reactant 2

HCID 155726661-(Piperidin-4-yl)-1,3-diazinan-2-oneHCID 70158074HCID 70158074, compound

Product 1

HCID 70160348HCID 70160348, compound

Reagents, catalysts & solvents 1

HCID 962WaterSolvent

Procedure

Using standard reductive amination conditions 4-(tetrahydro-2-oxo-1(2H)-pyrimidinyl)piperidine (Miller, S C; Jacobs, R T; Shenvi, A B. EP 739891) was reacted with N-[2-(4-chlorophenyl)-4-oxobutyl]-N-methyl-3-nitro-1-naphthamide [Example 3] and converted to the citrate salt. MS m/z 578 (M+H). Analysis for C31H36ClN5O4.1.0 C6H8O7.0.8 H2O: calculated: C, 56.64; H, 5.86; N, 8.92; found: C, 56.60; H, 5.74; N, 8.69.

Sources & evidence

ORD record
ord-fc35fc73314c4feeb86a621082f13485
Source dataset
uspto-grants-2002_04
Patent number
US06365602B1

Reaction notes

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