N-(5-chloro-1-((3S,4S)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl)-1H-pyrazol-4-yl)-6-(methylimino)-5-(trifluoromethyl)-1,6-dihydropyrimidin-2-amine N2-(5-氯-1-(反式-3-氟-1-(氧杂环丁烷-3-基)哌啶-4-基)-1H-吡唑-4-基)-N4-甲基-5-(三氟甲基)嘧啶-2,4-二胺
CAS 1536200-31-3 MFCD636200313
化学结构图
SMILES: CNc1nc(Nc2cnn([C@@H]3CCN(C4COC4)C[C@H]3F)c2Cl)ncc1C(F)(F)F
化学属性
| Mol. Weight | 449.83 |
|---|---|
| Appearance | white to off-white solid powder |
| Solubility | Soluble in DMSO, not in water |
别名和识别编码
| Chemical Name | N-(5-chloro-1-((3S,4S)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl)-1H-pyrazol-4-yl)-6-(methylimino)-5-(trifluoromethyl)-1,6-dihydropyrimidin-2-amine |
|---|---|
| Formula | C17H20ClF4N7O |
| Synonym | GNE9605; GNE-9605; GNE 9605. |
| IUPAC Name | N2-(5-chloro-1-((3R,4R)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl)-1H-pyrazol-4-yl)-N4-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine. |
| InChIKey | PUXPEQJKNAWNQA-DGCLKSJQSA-N |
| InChI | InChI=1S/C17H20ClF4N7O/c1-23-15-10(17(20,21)22)4-24-16(27-15)26-12-5-25-29(14(12)18)13-2-3-28(6-11(13)19)9-7-30-8-9/h4-5,9,11,13H,2-3,6-8H2,1H3,(H2,23,24,26,27)/t11-,13-/m1/s1 |
| Canonical SMILES | FC(C1=CN=C(NC2=C(Cl)N([C@H]3[C@H](F)CN(C4COC4)CC3)N=C2)N=C1NC)(F)F |
| Chemical Name Translation | N2-(5-氯-1-(反式-3-氟-1-(氧杂环丁烷-3-基)哌啶-4-基)-1H-吡唑-4-基)-N4-甲基-5-(三氟甲基)嘧啶-2,4-二胺 |
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产品应用
- GNE-9605 is a highly potent, selective, and brain-penetrant aminopyrazole leucine-rich repeat kinase 2 (LRRK2) small molecule inhibitors. Leucine-rich repeat kinase 2 (LRRK2) has drawn significant interest in the neuroscience research community because it is one of the most compelling targets for a potential disease-modifying Parkinson's disease therapy.
