HuagongsheHuagongshe Chemistry Print Report · For research reference only
5-Isocyanatoisoquinoline → N-(4-bromo-3-fluorobenzyl)-N'-(3-methyl-5-isoquinolinyl)urea
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 5-Isocyanatoisoquinoline | HCID 11586357 | — |
| Reactant | 5-Isocyanato-3-methylisoquinoline | HCID 22228382 | — |
| Reactant | (4-Bromo-3-fluorophenyl)methanamine | HCID 22337664 | — |
| Product | N-(4-bromo-3-fluorobenzyl)-N'-(3-methyl-5-isoquinolinyl)urea | HCID 10430331 | — |
Reaction Steps
The title compound was prepared using the procedure described in Example 61B using 4-bromo-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 9.68 (s, 1H), 9.46 (s, 1H), 8.51 (m, 2H), 8.01 (d, 1H, J=7.8 Hz), 7.80 (t, 1H, J=7.8 Hz), 7.67 (m, 2H), 7.36 (dd, 1H, J=9, 1.5 Hz), 7.18 (dd, 1H, J=9, 1 Hz), 4.39 (d, 2H, J=6 Hz), 2.77 (s, 3H); MS (ESI) 388/390 (M+H)+; Anal. Calcd for C18H15BrFN3O.HCl: C, 50.91; H, 3.80; N, 9.89. Found: C, 50.81; H, 3.74; N, 9.87
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US07335678B2 |
| Source dataset | uspto-grants-2008_02 |
| ORD ID | ord-bd6c04abc3314934812fa7ce039c6e7b |
| Source note | uspto-grants-2008_02 |