Diisopropylethylamine → HCID 21101710, compound

HRID 1353417Notes

Reaction equation

HRID 1353417 reaction equation
N[C:2]1[C:11]2[O:10][CH2:9][CH2:8][O:7][C:6]=2[CH:5]=[CH:4][CH:3]=1.ClC(OC1C=CC([N+]([O-])=O)=CC=1)=[O:14].C([N:28]([CH:31](C)C)CC)(C)C.[Cl:34][C:35]1[CH:44]=[C:43]2[C:38]([C:39]([N:45]3[CH2:50][CH2:49][NH:48][CH2:47][CH2:46]3)=[CH:40][CH:41]=[N:42]2)=[CH:37][CH:36]=1>>[Cl:34][C:35]1[CH:44]=[C:43]2[C:38]([C:39]([N:45]3[CH2:50][CH2:49][N:48]([C:31]([NH:28][C:3]4[CH:4]=[CH:5][C:6]5[O:7][CH2:8][CH2:9][O:10][C:11]=5[CH:2]=4)=[O:14])[CH2:47][CH2:46]3)=[CH:40][CH:41]=[N:42]2)=[CH:37][CH:36]=1

Participants

5

Reactant 4

HCID 81531DiisopropylethylamineHCID 821294-Nitrophenyl chloroformateHCID 7383897-Chloro-4-(piperazin-1-yl)quinolineHCID 117883872,3-Dihydro-1,4-benzodioxin-5-amine

Product 1

HCID 21101710HCID 21101710, compound

Procedure

As described for example 78, 5-amino-1,4-benzodioxane, p-nitrophenyl chloroformate, diisopropylethyl amine, and 7-chloro-4-piperazinylquinoline are reacted to afford the product. LC-MS: 425 (M++1). 1H NMR (DMSO-d6) δ 8.70 (d, 1H), 8.50 (s, 1H), 8.05 (d, 1H), 7.95 (s, 1H), 7.55 (d, 1H), 7.00 (m, 2H), 6.85 (d, 1H), 6.70 (d, 1H), 4.15 (m, 4H), 3.65 (m, 4H), 3.20 (m, 4H).

Workup

  1. customare reacted
  2. customto afford the product

Sources & evidence

ORD record
ord-9e63c2b61166442885e82b494cc29897
Source dataset
uspto-grants-2007_05
Patent number
US07220856B2

Reaction notes

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