HuagongsheHuagongshe Chemistry Print Report · For research reference only
2486-69-3 → HCID 25253068, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 2486-69-3 | HCID 288057 | — |
| Reactant | HCID 57955616 | HCID 57955616 | — |
| Catalyst | Hydrochloric Acid | HCID 313 | — |
| Solvent | Isopropanol | HCID 3776 | — |
| Product | HCID 25253068 | HCID 25253068 | — |
Reaction Steps
2-Chloro-9-cyclopentyl-7-fluoro-5-methyl-7-vinyl-8,9-dihydro-5H-pyrimido[4,5-b][1,4]diazepin-6(7H)-one, 4-amino-3-methoxy benzoic acid (1.2 equivalent), i-PrOH and conc. HCl (30 drops) were heated to 95° C. for 18 hours. A this time the reaction was cooled to room temperature and filtered to reveal the product as a tan solid in good yield). 1H NMR (400 MHz, DMSO-d6) δ ppm 1.51-1.75 (m, 6 H) 1.85 (m, 2 H) 3.29 (s, 3 H) 3.73-3.97 (m, 2 H) 3.93 (s, 3 H) 4.94 (m, 1 H) 5.40-5.54 (m, 2 H) 6.05 (m, 1 H) 7.48-7.65 (m, 2 H) 8.09 (d, J=8.34 Hz, 1 H) 8.23 (s, 1 H) 9.51 (br. s., 1 H). [M+H] calculated for C23H26FN5O4, 456; found 456.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08318727B2 |
| Source dataset | uspto-grants-2012_11 |
| ORD ID | ord-aa6491c2a49b42af986cef4f0b0fe250 |
| Source note | uspto-grants-2012_11 |