(S)-(4-((5-fluoro-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)pyrimidin-2-yl)amino)phenyl)(3-(methylamino)pyrrolidin-1-yl)methanone (S)-(4-((5-氟-4-(1-异丙基-2-甲基-1H-咪唑-5-基)嘧啶-2-基)氨基)苯基)(3-(甲基氨基)吡咯烷哌嗪-1-基)甲酮
CAS 924641-59-8 MFCD024641598
化学结构图
SMILES: CN[C@H]1CCN(C(=O)c2ccc(Nc3ncc(F)c(-c4cnc(C)n4C(C)C)n3)cc2)C1
化学属性
| Mol. Weight | 437.51312 |
|---|---|
| Appearance | Solid powder |
| Solubility | Soluble in DMSO, not in water |
别名和识别编码
| Chemical Name Translation | (S)-(4-((5-氟-4-(1-异丙基-2-甲基-1H-咪唑-5-基)嘧啶-2-基)氨基)苯基)(3-(甲基氨基)吡咯烷哌嗪-1-基)甲酮 |
|---|---|
| InChIKey | NTSDIJMNXYJJNG-SFHVURJKSA-N |
| Chemical Name | (S)-(4-((5-fluoro-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)pyrimidin-2-yl)amino)phenyl)(3-(methylamino)pyrrolidin-1-yl)methanone |
| Formula | C23H28FN7O |
| Synonym | AZD5597; AZD 5597; AZD-5597 |
| IUPAC Name | (S)-(4-((5-fluoro-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)pyrimidin-2-yl)amino)phenyl)(3-(methylamino)pyrrolidin-1-yl)methanone |
| InChI | InChI=1S/C23H28FN7O/c1-14(2)31-15(3)26-12-20(31)21-19(24)11-27-23(29-21)28-17-7-5-16(6-8-17)22(32)30-10-9-18(13-30)25-4/h5-8,11-12,14,18,25H,9-10,13H2,1-4H3,(H,27,28,29)/t18-/m0/s1 |
| Canonical SMILES | O=C(C1=CC=C(NC2=NC=C(F)C(C3=CN=C(C)N3C(C)C)=N2)C=C1)N4C[C@@H](NC)CC4 |
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产品应用
- AZD-5597 is potent CDK inhibitor with in vitro anti-proliferative effects against a range of cancer cell lines. AZD-5597 has excellent physiochemical properties and large margins against inhibition of CYP isoforms and the hERG ion channel.
