化学标识
Palbociclib Impurity C
CAS 1821428-35-6 · C26H31N5O3
01化学标识
| LazyChem 编号 | LC-24565 |
|---|---|
| CAS RN | 1821428-35-6 |
| PubChem CID | 118502708 |
| 分子式 | C26H31N5O3 |
| 分子量 | 461.56 g/mol |
| IUPAC 名称 | 8-[6-[3-(Dimethylamino)propoxy]-3-pyridinyl]-1,3-dihydro-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-2H-imidazo[4,5-c]quinolin-2-one |
| InChIKey | AOTRIQLYUAFVSC-UHFFFAOYSA-N |
02结构与立体化学

| 分子式 | C26H31N5O3 |
|---|---|
| InChIKey | AOTRIQLYUAFVSC-UHFFFAOYSA-N |
| 环数 | 5 |
| 已定义立体中心 | 0 |
| 未指定立体中心 | 0 |
| SMILES | CN1C2=CN=C3C=CC(=CC3=C2N(C1=O)C4CCOCC4)C5=CN=C(C=C5)OCCCN(C)C |
|---|---|
| InChI | InChI=1S/C26H31N5O3/c1-29(2)11-4-12-34-24-8-6-19(16-28-24)18-5-7-22-21(15-18)25-23(17-27-22)30(3)26(32)31(25)20-9-13-33-14-10-20/h5-8,15-17,20H,4,9-14H2,1-3H3 |
03印度监管状态
仅将精确化合物与公布的标识符进行比较。作出监管决定前请核对现行官方文件。
04名称与关联
原料药与母体药物
Palbociclib
杂质与相关化合物名称与关联
- Azd-0156
- 8-[6-[3-(dimethylamino)propoxy]pyridin-3-yl]-3-methyl-1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-one
- 2H-Imidazo[4,5-c]quinolin-2-one, 8-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-1,3-dihydro-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-
- 8-(6-(3-(dimethylamino)propoxy)pyridin-3-yl)-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-imidazo[4,5-c]quinolin-2(3H)-one
- AZD 0156 [WHO-DD]
- 8-(6-(3-(Dimethylamino)propoxy)pyridin-3-yl)-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1,3-dihydro-2H-imidazo[4,5-c]quinolin-2-one
05来源
- S01PubChem CID 118502708
结构和机器可读的化学标识符。
