JTT 551

COA

级别和纯度:

≥99%

CAS编号: 776309-04-7
分子式: C₃₄H₄₃N₃O₃S₂
分子量: 605.85
PubChem编号: 23080446

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货号 (SKU)	包装规格	是否现货	价格	数量
J649300-5mg	5mg	期货
J649300-10mg	10mg	期货

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Glucose Metabolism (3713) Metabolic Enzyme/Protease (4889) Phosphatase (222)

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基本描述

英文别名	2-(((5-(tert-Butyl)thiazol-2-yl)methyl)((4-(4-((4-(heptan-4-yl)phenoxy)methyl)phenyl)thiazol-2-yl)methyl)amino)acetic acid \| GLYCINE, N-((5-(1,1-DIMETHYLETHYL)-2-THIAZOLYL)METHYL)-N-((4-(4-((4-(1-PROPYLBUTYL)PHENOXY)METHYL)PHENYL)-2-THIAZOLYL)METHYL)- \| H
规格或纯度	≥99%
英文名称	JTT 551
生化机理	JTT 551 是一种选择性的蛋白酪氨酸磷酸酶 1B （PTP1B）抑制剂，对 PTP1B 和 TCPTP（T 细胞蛋白酪氨酸磷酸酶）的 K i s 分别为 0.22 μM 和 9.3 μM；JTT 551 可用于 2 型糖尿病的研究。
储存温度	2-8°C储存,避光,干燥
运输条件	冰袋运输
产品介绍	JTT 551 is selective a protein tyrosine phosphatase 1B ( PTP1B ) inhibitor, with K i s of 0.22 μM and 9.3 μM for PTP1B and TCPTP (T-cell protein tyrosine phosphatase), respectively; JTT 551 can be used in the research of type 2 diabetes mellitus. In Vitro JTT 551 is selective a protein tyrosine phosphatase 1B (PTP1B) inhibitor, with K i s of 0.22 μM and 9.3 μM for PTP1B and TCPTP (T-cell protein tyrosine phosphatase), respectively. JTT 551 shows low affinity at CD45 PTP (CD45) and leucocyte common antigen-related (LAR) PTP with K i s of both >30 μM. Furthermore, JTT-551 (10 and 30 μM) enhances the insulin-induced deoxyglucose uptake in a dosedependent manner. MCE has not independently confirmed the accuracy of these methods. They are for reference only. In Vivo JTT 551 (3 mg/kg, 30 mg/kg, p.o.) dose-dependently decreases blood glucose level on Days 7, 14 and 28 in db/db Mice. JTT 551 also significantly reduces triglyceride (TG) level at 30 mg/kg on Day 7 but does not alter insulin and total cholesterol (TC) levels . MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:IC50: 0.22 μM (PTP1B), 9.3 μM (TCPTP)
纯度	≥99%

关联靶点（人）

PTPN1 Tchem 酪氨酸蛋白磷酸酶非受体 1 型(Tyrosine-protein phosphatase non-receptor type 1) (2 活性数据)

点击查看靶蛋白信息： PTPN1

活性类型	活性值-log(M)	作用机制	期刊	参考文献(PubMed IDs)

关联靶点（其它种属）

Ptpn1 Protein-tyrosine phosphatase 1B (270 活性数据)

点击查看靶蛋白信息： Ptpn1

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

作用机制

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

名称和识别符

分子类型	小分子
IIUPAC Name	2-[(5-tert-butyl-1,3-thiazol-2-yl)methyl-[[4-[4-[(4-heptan-4-ylphenoxy)methyl]phenyl]-1,3-thiazol-2-yl]methyl]amino]acetic acid
INCHI	1S/C34H43N3O3S2/c1-6-8-25(9-7-2)26-14-16-28(17-15-26)40-22-24-10-12-27(13-11-24)29-23-41-32(36-29)20-37(21-33(38)39)19-31-35-18-30(42-31)34(3,4)5/h10-18,23,25H,6-9,19-22H2,1-5H3,(H,38,39)
InChi Key	FKGBFRNVTCFMGU-UHFFFAOYSA-N
Smiles	CCCC(CCC)C1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=CSC(=N3)CN(CC4=NC=C(S4)C(C)(C)C)CC(=O)O
Isomeric SMILES	CCCC(CCC)C1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=CSC(=N3)CN(CC4=NC=C(S4)C(C)(C)C)CC(=O)O
关联CAS	776309-04-7
PubChem CID	23080446
MeSH Entry Terms	(((5-(1,1-dimethylethyl)thiazol-2-yl)methyl)(((4-(4-(4-(1-propylbutyl)phenoxy)methyl)phenyl)thiazol-2-yl)methyl)amino)acetic acid;JTT 551;JTT-551;JTT551;monosodium (((5-(1,1-dimethylethyl)thiazol-2-yl)methyl)(((4-(4-(4-(1-propylbutyl)phenoxy)methyl)phenyl
分子量	605.85

化学和物理性质

溶解性	DMSO : 100 mg/mL (165.06 mM; Need ultrasonic)
分子量	605.900 g/mol
XLogP3	6.800
氢键供体数Hydrogen Bond Donor Count	1
氢键受体数Hydrogen Bond Acceptor Count	8
可旋转键计数Rotatable Bond Count	16
精确质量Exact Mass	605.275 Da
单同位素质量Monoisotopic Mass	605.275 Da
拓扑极表面积Topological Polar Surface Area	132.000 Å²
重原子数Heavy Atom Count	42
形式电荷Formal Charge	0
复杂度Complexity	789.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	0
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1