化学标识
Palbociclib Piperazine N-Oxide Impurity
CAS 2174002-29-8 · C24H29N7O3
01化学标识
| LazyChem 编号 | LC-24570 |
|---|---|
| CAS RN | 2174002-29-8 |
| PubChem CID | 152630072 |
| 分子式 | C24H29N7O3 |
| 分子量 | 463.5 g/mol |
| IUPAC 名称 | 1-(6-((6-acetyl-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino)pyridin-3-yl)piperazine 1-oxide |
| InChIKey | ZDIMBNTYWUUTJC-UHFFFAOYSA-N |
02结构与立体化学

| 分子式 | C24H29N7O3 |
|---|---|
| InChIKey | ZDIMBNTYWUUTJC-UHFFFAOYSA-N |
| 环数 | 5 |
| 已定义立体中心 | 0 |
| 未指定立体中心 | 0 |
| SMILES | CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)[N+]4(CCNCC4)[O-])C5CCCC5)C(=O)C |
|---|---|
| InChI | InChI=1S/C24H29N7O3/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)31(34)11-9-25-10-12-31)29-22(19)30(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29) |
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
- 6-Acetyl-8-cyclopentyl-5-methyl-2-[[5-(1-oxido-1-piperazinyl)-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7(8H)-one
- 1-(6-((6-Acetyl-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino)pyridin-3-yl)piperazine 1-oxide
- Palbociclib N-oxide
- 1-[6-({6-acetyl-8-cyclopentyl-5-methyl-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-2-yl}amino)pyridin-3-yl]piperazin-1-ium-1-olate
- 6-Acetyl-8-cyclopentyl-5-methyl-2-[[5-(1-oxidopiperazin-1-ium-1-yl)pyridin-2-yl]amino]pyrido[2,3-d]pyrimidin-7-one
- 1-Piperazin-N-oxide Palbociclib
- Pyrido(2,3-d)pyrimidin-7(8H)-one, 6-acetyl-8-cyclopentyl-5-methyl-2-((5-(1-oxido-1-piperazinyl)-2-pyridinyl)amino)-
- Palbociclib Impurity S
- UNII-CQ6Y33H744
05来源
- S01PubChem CID 152630072
结构和机器可读的化学标识符。
