化工社化工社 化学情報印刷レポート · 研究参考用
Ro3280 → 4-(9-cyclopentyl-7-fluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide
関与物質
| 役割 | 名称 | HCID | 仕込み量 |
|---|---|---|---|
| 反応物 | Ro3280 | HCID 25015677 | — |
| 反応物 | 2-Fluoro-beta-alaninate | HCID 86635893 | — |
| 生成物 | 4-(9-cyclopentyl-7-fluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide | HCID 25255106 | — |
反応手順
The title compound was synthesized using an analogous procedure to that described in connection with Compound 3 except that 2-fluoro-beta-alaninate was used as the starting material. The final product was purified on reversed phase HPLC as TFA salt. 1H NMR (400 MHz, DMSO-d6) δ ppm 1.55-1.87 (m, 11 H) 1.91-2.08 (m, 3 H) 2.18 (s, 3 H) 2.79 (d, J=11.4 Hz, 2 H) 3.24 (s, 3 H) 3.61-3.83 (m, 3 H) 3.94 (s, 3 H) 4.77 (quin., J=8.3 Hz, 1 H) 5.52 (qd, 1 H) 7.47 (dd, J=1.8 Hz, 1 H) 7.49 (s, 1 H) 7.86 (s, 1 H) 8.11 (d, J=7.8 Hz, 1 H) 8.16 (s, 1 H) 8.33 (d, J=8.34 Hz, 1 H). [M+H] calc'd for C27H36FN7O3 526; found 526.
情報源と証拠
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 特許番号 | US08318727B2 |
| 出典データセット | uspto-grants-2012_11 |
| ORD ID | ord-a52df4f994de4ffbadd7af3982ee564d |
| 出典メモ | uspto-grants-2012_11 |