HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Fluorophenyl isocyanate → Methyl 2-(3-(4-(3-(2-fluorophenyl)ureido)phenyl)isoxazole-5-carboxamido)-3-phenylpropanoate
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 2-Fluorophenyl isocyanate | HCID 85588 | — |
| Reactant | Methyl 2-(3-(4-aminophenyl)isoxazole-5-carboxamido)-3-phenylpropanoate | HCID 67355008 | — |
| Product | Methyl 2-(3-(4-(3-(2-fluorophenyl)ureido)phenyl)isoxazole-5-carboxamido)-3-phenylpropanoate | HCID 67354286 | 88% |
Reaction Steps
The title compound was prepared according to the procedure as set forth in example 151, except that 1-fluoro-2-isocyanatobenzene was used in place of 1-fluoro-3-isocyanatobenzene and methyl 2-(3-(4-aminophenyl)isoxazole-5-carboxamido)-3-phenylpropanoate was used in place of methyl 2-(3-(4-aminophenyl)isoxazole-5-carboxamido)-3-methylbutanoate to yield 88% of the title compound. MS (ESI): m/z 503.2 (M+H)+; 1HNMR (DMSO-d6, 300 MHz): δ 9.43 (d, 1H), 9.33 (s, 1H), 8.63 (s, 1H), 8.16 (dt, 1H), 7.84 (d, 2H), 7.61 (d, 2H), 7.56 (s, 1H), 7.27 (d, 4H), 7.23 (m, 2H), 7.15 (t, 1H), 7.00 (m, 1H), 4.74 (m, 1H), 3.65 (s, 3H), 3.23 (m, 2H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08835428B2 |
| Source dataset | uspto-grants-2014_09 |
| ORD ID | ord-719b4d9698e34c2993654d4bed0cc8b8 |
| Source note | uspto-grants-2014_09 |