产品名称

英文名称：ABT-199 (GDC-0199)

同义词

Venetoclax、1257044-40-8、ABT-199、Venclexta、GDC-0199、ABT199、ABT 199、venclyxto、RG7601、UNII-N54AIC43PW、GDC 0199、RG-7601、Venetoclax (ABT199)、N54AIC43PW、Venetoclax; Abt-199、Venetoclax(ABT-199)、4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperaz、GDC-0199、维奈妥拉、4-(4-｛[2-(4-氯苯基)-4,4-二甲基环己-1-烯-1-基]甲基｝哌嗪-1-基)-N-(｛3-硝基-4-[(四氢-2H-吡喃-4-基甲基)氨基]苯基｝磺酰基)-2-(1H-吡咯并[2,3-b]吡啶-5-基氧基)苯甲酰胺)

产品性质

CAS编号：1257044-40-8

分子式：C45H50ClN7O7S

分子量：868.44

PubChem编号：49846579

别名：GDC-0199|维奈妥拉|4-(4-｛[2-(4-氯苯基)-4,4-二甲基环己-1-烯-1-基]甲基｝哌嗪-1-基)-N-(｛3-硝基-4-[(四氢-2H-吡喃-4-基甲基)氨基]苯基｝磺酰基)-2-(1H-吡咯并[2,3-b]吡啶-5-基氧基)苯甲酰胺)

英文别名：Venetoclax|1257044-40-8|ABT-199|Venclexta|GDC-0199|ABT199|ABT 199|venclyxto|RG7601|UNII-N54AIC43PW|GDC 0199|RG-7601|Venetoclax (ABT199)|N54AIC43PW|Venetoclax; Abt-199|Venetoclax(ABT-199)|4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperaz

规格或纯度：≥99%

英文名称：ABT-199 (GDC-0199)

生化机理：ABT-199 is a potent and selective inhibitor of B-cell lymphoma-2 (BCL-2) family proteins, currently in clinical trials. ABT-199 inhibits the growth of BCL-2-dependent tumors in vivo and spares human platelets. A single dose of ABT-199 in three patients with refractory chronic lymphocytic leukemia resulted in tumor lysis within 24 h. These data indicate that selective pharmacological inhibition of BCL-2 shows promise for the treatment of BCL-2-dependent hematological cancers.Potent, selective Bcl-2 inhibitor (K i <0.01 nM) that inhibits the growth of Bcl-2–dependent tumors while sparing platelets. Bcl-2–specific BH3 mimetic. Promising agent in the treatment\xa0of chronic lymphocytic leukaemic and estrogen receptor-positive br

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：ABT-199 (GDC-0199)是高效的Bcl-2选择性抑制剂，Ki为0.01 nM，比对Bcl-xL和Bcl-w的抑制性高4800倍以上，对Mcl-1无活性。A Bcl-2-selective inhibitor with Ki of <0.01 nMABT-199 (GDC-0199) is a BH3 mimetic that Bcl-2-selective inhibitor with Ki of <0.01 nM. B-cell lymphoma/leukemia 2 (Bcl-2) is an anti-apoptotic protein that controls cell survival by binding the BH3 domains of pro-death BAD and BAK proteins and preventing permeabilization of the mitochondrial outer membrane. This protein is tightly regulated for the homeostasis between cell growth and cell death.A Bcl-2-selective inhibitor with Ki of <0.01 nM

ALogP：8.2

PubChem SID：488201440

PubChem SID url：https//pubchem.ncbi.nlm.nih.gov/substance/488201440

IUPAC Name：4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonyl-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide

INCHI：InChI=1S/C45H50ClN7O7S/c1-45(2)15-11-33(39(26-45)31-3-5-34(46)6-4-31)29-51-17-19-52(20-18-51)35-7-9-38(42(24-35)60-36-23-32-12-16-47-43(32)49-28-36)44(54)50-61(57,58)37-8-10-40(41(25-37)53(55)56)48-27-30-13-21-59-22-14-30/h3-10,12,16,23-25,28,30,48H,11,13-15,17-22,26-27,29H2,1-2H3,(H,47,49)(H,50,54)

InChi Key：LQBVNQSMGBZMKD-UHFFFAOYSA-N

Canonical SMILES：CC1(CCC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)NS(=O)(=O)C5=CC(=C(C=C5)NCC6CCOCC6)[N+](=O)[O-])OC7=CN=C8C(=C7)C=CN8)C

Isomeric SMILES：CC1(CCC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)NS(=O)(=O)C5=CC(=C(C=C5)NCC6CCOCC6)[N+](=O)[O-])OC7=CN=C8C(=C7)C=CN8)C

PubChem CID：49846579

CAS Registry No.：1257044-40-8

ChEMBL Ligand：CHEMBL3137309

RCSB PDB Ligand：LBM

DrugCentral Ligand：5133

溶解性：Soluble in DMSO (100 mg/ml (~115mM) at 25 °C), water (<1 mg/ml (< 1mM) at 25 °C), and ethanol (<1 mg/ml (< 1mM) at 25 °C).

敏感性：对光敏感

折光率：1.64

象形图：

信号词：Danger

危险声明：H315 Causes skin irritationH319 Causes serious eye irritationH335 May cause respiratory irritationH302 Harmful if swallowedH372 Causes damage to organs through prolonged or repeated exposureH361 Suspected of damaging fertility or the unborn child

预防措施声明：P261,P305+P351+P338,P280,P302+P352,P321,P405,P501,P264,P260,P271,P270,P304+P340,P403+P233,P362+P364,P330,P203,P264+P265,P301+P317,P318,P337+P317,P332+P317,P319

产品包装