HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Fluorobenzaldehyde → HCID 178513974, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 4-Fluorobenzaldehyde | HCID 68023 | — |
| Reactant | Ammonium Acetate | HCID 517165 | — |
| Reactant | (1S,2S,3R,4R)-3-(2,3-Diamino-5-bromo-pyridin-4-ylamino)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid amide | HCID 117701905 | — |
| Product | HCID 178513974 | HCID 178513974 | 54.2% |
Reaction Steps
In a similar fashion to compound CXXV, (1S,2S,3R,4R)-3-(2,3-Diamino-5-bromo-pyridin-4-ylamino)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid amide (100.00 mg, 0.29568 mmol), 4-Fluorobenzaldehyde (40.4 mg, 0.325 mmol), and Ammonium acetate (45.6 mg, 0.591 mmol) were reacted to yield 70.9 mg (54%) of the title compound. (300 MHz, DMSO-d6) 13.42 (s, 1H), 8.06 (s, 1H), 7.99 (d, J=8 Hz, 1H), 7.90 (d, J=11 Hz, 1H), 7.76 (s, 1H), 7.61 (m, 1H), 7.33 (m, 1H), 7.24 (m, 2H) 6.39 (s, 2H), 5.21 (t, J=17 Hz, 8.5 Hz, 1H), 2.89 (s, 1H), 2.78 (s, 1H), 2.63 (d, J=8 Hz, 1H), 2.24 (d, J=8 Hz, 1H), 1.39 (d, J=8 Hz, 1H). MS=444 (M+H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09238656B2 |
| Source dataset | uspto-grants-2016_01 |
| ORD ID | ord-6a767d8de5614f6f9d486c30d492e90a |
| Source note | uspto-grants-2016_01 |