产品名称

英文名称：Abemaciclib

同义词

Abemaciclib、1231929-97-7、LY2835219、Verzenio、LY2835219 free base、LY-2835219、UNII-60UAB198HK、Verzenios、N-(5-((4-ethylpiperazin-1-yl)methyl)pyridin-2-yl)-5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazol-6-yl)pyrimidin-2-amine、60UAB198HK、LY 28352、N-[5-[(4-乙基-1-哌嗪基)甲基]-2-吡啶基]-5-氟-4-[4-氟-2-甲基-1-异丙基-1H-苯并咪唑-6-基]-2-嘧啶胺、玻玛西林、阿贝西利

产品性质

CAS编号：1231929-97-7

分子式：C27H32F2N8

分子量：506.59

PubChem编号：46220502

别名：N-[5-[(4-乙基-1-哌嗪基)甲基]-2-吡啶基]-5-氟-4-[4-氟-2-甲基-1-异丙基-1H-苯并咪唑-6-基]-2-嘧啶胺|玻玛西林|阿贝西利

英文别名：Abemaciclib|1231929-97-7|LY2835219|Verzenio|LY2835219 free base|LY-2835219|UNII-60UAB198HK|Verzenios|N-(5-((4-ethylpiperazin-1-yl)methyl)pyridin-2-yl)-5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazol-6-yl)pyrimidin-2-amine|60UAB198HK|LY 28352

规格或纯度：97%

英文名称：Abemaciclib

储存温度：避光,-20°C储存

运输条件：超低温冰袋运输

产品介绍：Abemaciclib highly selective inhibits the complexes CDK4/ cyclin D1 (IC50 =2 nmol/L) and CDK6/cyclin D1 (IC50 =10 nmol/L), with no activity against other CDK/cyclin complexes or cell-cycle-related kinases within the nanomolar ranges, except for inhibition of CDK9 at IC50 at least five times higher. Besides the cell-cycle dependent activity, abemaciclib is able to boost antitumor immunity by potentiating tumor antigen presentation and selectively suppressing proliferation of regulatory T (Treg) cells at the same time. Consistent with its activity against CDK4 and CDK6, abemaciclib inhibits RB phosphorylation and leads to G1 arrest in RB-proficient cell lines. In vitro, treatment with abemaciclib resulted in increased activation of human T cells and upregulated expression of antigen presentation genes in MCF-7 breast cancer cells.

ALogP：3.8

IUPAC Name：N-[5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine

INCHI：InChI=1S/C27H32F2N8/c1-5-35-8-10-36(11-9-35)16-19-6-7-24(30-14-19)33-27-31-15-22(29)25(34-27)20-12-21(28)26-23(13-20)37(17(2)3)18(4)32-26/h6-7,12-15,17H,5,8-11,16H2,1-4H3,(H,30,31,33,34)

InChi Key：UZWDCWONPYILKI-UHFFFAOYSA-N

Canonical SMILES：CCN1CCN(CC1)CC2=CN=C(C=C2)NC3=NC=C(C(=N3)C4=CC5=C(C(=C4)F)N=C(N5C(C)C)C)F

Isomeric SMILES：CCN1CCN(CC1)CC2=CN=C(C=C2)NC3=NC=C(C(=N3)C4=CC5=C(C(=C4)F)N=C(N5C(C)C)C)F

PubChem CID：46220502

CAS Registry No.：1231929-97-7

ChEMBL Ligand：CHEMBL3301610

RCSB PDB Ligand：6ZV

DrugCentral Ligand：5259

溶解性：insoluble in H2O; ≥4.83 mg/mL in DMSO with gentle warming and ultrasonic; ≥6.34 mg/mL in EtOH with gentle warming

敏感性：对光敏感

象形图：

信号词：Danger

危险声明：H373 Causes damage to organs through prolonged or repeated exposureH410 Very toxic to aquatic life with long lasting effectsH360 May damage fertility or the unborn child

预防措施声明：P273,P280,P308+P313,P314

产品包装