HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 392267Generated: October 26, 2026
Adenine → 2-(6-Aminopurin-9-ylmethyl)-3-biphenyl-2-yl-5-chloro-3H-quinazolin-4-one
https://huagongshe.com/reaction/392267
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Adenine | HCID 190 | — |
| Reactant | Potassium Carbonate | HCID 11430 | — |
| Reactant | 3-Biphenyl-2-yl-5-chloro-2-chloromethyl-3H-quinazolin-4-one | HCID 22316579 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | 2-(6-Aminopurin-9-ylmethyl)-3-biphenyl-2-yl-5-chloro-3H-quinazolin-4-one | HCID 10116665 | 68.3% |
Reaction Steps
Prepared according to Procedure C using Intermediate 2i (400 mg, 1.05 mmol), adenine (155 mg, 1.15 mmol), K2CO3 (159 mg, 1.15 mmol), and DMF (5 mL). The crude product was recrystallized from EtOH to provide 344 mg of a white solid (68%), mp 299.9-300.1° C. (discolors). 1H NMR (DMSO-d6) δ: 8.08 (s, 1H); 7.89 (s, 1H); 7.58-7.73 (m, 5H); 7.51 (d, J=7.9 Hz, 1H); 7.46 (d, J=7.5 Hz, 2H); 7.27-7.41 (m, 3H); 7.14-7.27 (m, 3H); 5.14 (d, J=17 Hz, 1H); 4.82 (d, J=17 Hz, 1H). 13C NMR (DMSO-d6) ppm: 159.6, 156.2, 152.8, 152.5, 150.0, 149.0, 141.7, 140.2, 137.7, 135.0, 133.3, 133.2, 131.8, 130.7, 130.1, 129.8, 129.5, 128.8, 128.6, 128.4, 127.1, 118.4, 117.6, 45.3. MS (ES): m/z 480.1 (M+). Anal. calcd. for C26H18ClN7O: C, 65.07; H, 3.78; Cl, 7.39; N, 20.43. Found: C, 64.77; H, 3.75; Cl, 7.43; N, 20.35.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US06800620B2 |
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| Source dataset | uspto-grants-2004_10 |
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| ORD ID | ord-875649e17cb9402680ab50879fc5fff9 |
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| Source note | uspto-grants-2004_10 |
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