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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2056875Generated: October 26, 2026

5-Isocyanatoisoquinoline → N-[4-(1-azepanyl)-3-fluorobenzyl]-N'-(3-methyl-5-isoquinolinyl)urea

https://huagongshe.com/reaction/2056875

Reaction equation

Participants

RoleNameHCIDCharge
Reactant5-IsocyanatoisoquinolineHCID 11586357—
Reactant5-Isocyanato-3-methylisoquinolineHCID 22228382—
Reactant4-(1-Azepanyl)-3-fluorobenzylamineHCID 22337567—
ProductN-[4-(1-azepanyl)-3-fluorobenzyl]-N'-(3-methyl-5-isoquinolinyl)ureaHCID 10092755—

Reaction Steps

The title compound was prepared using the procedure described in Example 61B using 4-(1-azepanyl)-3-fluorobenzylamine and the product from Example 154A instead of 4-cyanobenzyl alcohol and the product from Example 61A. 1H NMR (300 MHz, DMSO-d6) δ 9.74 (s, 1H), 8.50 (s, 1H), 8.67 (s, 1H), 8.60 (d, 1H, J=8.1 Hz), 8.14 (d, 1H, J=8.1 Hz), 7.83 (t, 1H, J=8.1 Hz), 7.56 (t, 1H), 7.04 (m, 2H), 6.90 (m, 1H), 4.26 (d, 2H, J=6 Hz), 3.32 (m, 4H), 2.79 (s, 3H), 1.75 (m, 4H), 1.55 (m, 4H); MS (ESI) 407 (M+H)+; Anal. Calcd for C24H27FN4O.2HCl: C, 60.13; H, 6.10; N, 11.69. Found: C, 60.09; H, 6.35; N, 11.47.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07335678B2
Source datasetuspto-grants-2008_02
ORD IDord-6ac8cc473795436cb4c92a73ccb61b29
Source noteuspto-grants-2008_02