HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 241229Generated: October 31, 2026
HCID 86647860, compound → ethyl {6-[4-(6,6-dimethyl-5,6,7,8-tetrahydroquinazolin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1H-imidazo[4,5-b]pyridin-2-yl}carbamate
https://huagongshe.com/reaction/241229
Participants
| Role | Name | HCID | Charge |
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| Reactant | HCID 86647860 | HCID 86647860 | — |
| Catalyst | Mercuric oxide | HCID 30856 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | ethyl {6-[4-(6,6-dimethyl-5,6,7,8-tetrahydroquinazolin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1H-imidazo[4,5-b]pyridin-2-yl}carbamate | HCID 59586322 | 7.8% |
Reaction Steps
A mixture of ethyl [1-({3-amino-5-[4-(6,6-dimethyl-5,6,7,8-tetrahydroquinazolin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]pyridine-2-yl}amino)ethenyl]carbamate (82 mg, 0.15 mmol) and mercury(II) oxide (33 mg, 0.15 mmol) in tetrahydrofuran (8 mL) was stirred at 70° C. for 24 h. On cooling to room temperature, the mixture filtered then concentrated and the residue purified by preparative reverse phase HPLC to afford the title Compound (6 mg, 3% yield over 2 steps) as a colorless solid. 1H NMR (400 MHz, methanol-d4): 8.51 (s, 1H), 8.49 (d, 1H), 8.22 (d, 1H), 7.72 (d, 1H), 7.66 (dd, 1H), 7.09 (d, 1H), 5.17 (s, 2H), 4.48 (m, 2H), 4.36 (q, 2H), 4.33 (m, 2H), 2.85 (m, 2H), 2.60 (s, 2H), 1.69 (m, 2H), 1.38 (t, 3H), 0.95 (s, 6H); MS (EI) for C28H31N7O3: 514 (MH+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08648066B2 |
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| Source dataset | uspto-grants-2014_02 |
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| ORD ID | ord-d1b33832d18f41e8b6047c2035cfb823 |
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| Source note | uspto-grants-2014_02 |
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