产品名称

英文名称：Duvelisib (IPI-145, INK1197)

同义词

Duvelisib、1201438-56-3、IPI-145、INK-1197、(S)-3-(1-((9H-Purin-6-yl)amino)ethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one、UNII-610V23S0JI、IPI 145、INK-1147、(S)-3-(1-(9H-purin-6-ylamino)ethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one、IPI145、610V23S0JI、IPI-145 (INK

产品性质

CAS编号：1201438-56-3

分子式：C22H17ClN6O

分子量：416.86

PubChem编号：50905713

英文别名：Duvelisib|1201438-56-3|IPI-145|INK-1197|(S)-3-(1-((9H-Purin-6-yl)amino)ethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one|UNII-610V23S0JI|IPI 145|INK-1147|(S)-3-(1-(9H-purin-6-ylamino)ethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one|IPI145|610V23S0JI|IPI-145 (INK

规格或纯度：≥98%

英文名称：Duvelisib (IPI-145, INK1197)

生化机理：IPI-145 suppresses murine/human B-cell proliferation with EC50 of 0.5 nM/0.5 nM and also inhibits human T-cell proliferation with EC50 of 9.5 nM . IPI-145 (10 mg/kg, p.o.) shows well pharmacokinetics with Cmax and AUC of 390 ng/mL and 137 ng/mL in mouse and rat. IPI-145 (10 mg/kg) is active in murine DTH model with ~50% ear swelling. IPI-145 (10 mg/kg) demonstrates dose-dependent effect in rat collagen induced arthritis (CIA) model. IPI-145 prevents inflammation and protects joint bone and cartilage in the rat CIA model. IPI-145 (10 mg/kg,QD) demonstrates activity in rat adjuvant induced polyarthritis model.

储存温度：-20°C储存

运输条件：超低温冰袋运输

产品介绍：Duvelisib (IPI-145) 是PI3K δ和γ高度选择性抑制剂, Ki和IC50分别为23 pM/243 pM和1 nM/50 nM。Duvelisib (IPI-145, INK1197) is a novel and selective PI3K δ/γ inhibitor with Ki and IC50 of 23 pM/243 pM and 1 nM/50 nM in cell-free assays, highly selective for PI3K δ/γ than other protein kinases.

ALogP：4.1

PubChem SID：488201452

PubChem SID url：https//pubchem.ncbi.nlm.nih.gov/substance/488201452

IUPAC Name：8-chloro-2-phenyl-3-[(1S)-1-(7H-purin-6-ylamino)ethyl]isoquinolin-1-one

INCHI：InChI=1S/C22H17ClN6O/c1-13(28-21-19-20(25-11-24-19)26-12-27-21)17-10-14-6-5-9-16(23)18(14)22(30)29(17)15-7-3-2-4-8-15/h2-13H,1H3,(H2,24,25,26,27,28)/t13-/m0/s1

InChi Key：SJVQHLPISAIATJ-ZDUSSCGKSA-N

Canonical SMILES：CC(C1=CC2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5

Isomeric SMILES：C[C@@H](C1=CC2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5

PubChem CID：50905713

ChEMBL Ligand：CHEMBL3039502

CAS Registry No.：1201438-56-3

DrugCentral Ligand：5296

溶解性：DMSO 84 mg/mL Water <1 mg/mL Ethanol <1 mg/mL

象形图：

信号词：Danger

危险声明：H360 May damage fertility or the unborn child

预防措施声明：P280,P405,P501,P203,P318

产品包装