Benzo-1,3-dioxole-5-acetic acid → HCID 178520183, compound

HRID 1909414Notes

Reaction equation

HRID 1909414 reaction equation
Cl.[O:2]1[C:6]2[CH:7]=[CH:8][CH:9]=[C:10]([CH:11]3[CH2:16][CH2:15][N:14]([CH2:17][CH2:18][C@H:19]4[CH2:24][CH2:23][C@H:22]([NH2:25])[CH2:21][CH2:20]4)[CH2:13][CH2:12]3)[C:5]=2[O:4][CH2:3]1.[O:26]1[C:30]2[CH:31]=[CH:32][C:33]([CH2:35][C:36](O)=[O:37])=[CH:34][C:29]=2[O:28][CH2:27]1>>[O:26]1[C:30]2[CH:31]=[CH:32][C:33]([CH2:35][C:36]([NH:25][C@H:22]3[CH2:21][CH2:20][C@H:19]([CH2:18][CH2:17][N:14]4[CH2:15][CH2:16][CH:11]([C:10]5[C:5]6[O:4][CH2:3][O:2][C:6]=6[CH:7]=[CH:8][CH:9]=5)[CH2:12][CH2:13]4)[CH2:24][CH2:23]3)=[O:37])=[CH:34][C:29]=2[O:28][CH2:27]1

Participants

3

Reactant 2

HCID 76115Benzo-1,3-dioxole-5-acetic acidHCID 178479251HCID 178479251, compound2×

Product 1

HCID 178520183HCID 178520183, compound

Procedure

The title compound, white solid (21.8 mg, 54.1%), MS (ISP) m/z=493.3 [(M+H)+], was prepared in accordance with the general method of example 1 from Trans-4-[2-(4-Benzo[1,3]dioxol-4-yl-piperidin-1-yl)-ethyl]-cyclohexylamine hydrochloride (intermediate A) (30 mg, 0.0818 mmol) and 2-(benzo[d][1,3]dioxol-5-yl)acetic acid.

Sources & evidence

ORD record
ord-8c1c91fb60cd43b8a4b3af8660136e28
Source dataset
uspto-grants-2013_12
Patent number
US08598357B2

Reaction notes

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