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Product details

名称

GSK1521498 free base

分子类型

小分子

别名

GSK1521498 游离碱

英文别名

英文名称

GSK1521498 free base

货号

G648354-5mg

包装规格

5mg

级别

Moligand™

浓度

≥98%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

GSK1521498 free base is a potent and selective μ-opioid receptor (MOR) antagonist. GSK1521498 free base has the potential for disorders of compulsive consumption of food, alcohol, and agents Form:Solid IC50& Target:μ Opioid Receptor/MOR

生化机理

GSK1521498 free base 是一种强效且具有选择性的μ-阿片受体（MOR）拮抗剂。GSK1521498 游离碱具有治疗强迫性食物、酒精和药物消费紊乱的潜力。

CAS号

1007573-18-3

分子式

C24H20F2N4

分子量

402.44 g/mol

PubChem编号

24737629

Isomeric SMILES

C1C(CC2=CC=CC=C21)NCC3=C(C=C(C=C3F)C4=CC(=CC=C4)C5=NC=NN5)F

IIUPAC Name

N-[[2,6-difluoro-4-[3-(1H-1,2,4-triazol-5-yl)phenyl]phenyl]methyl]-2,3-dihydro-1H-inden-2-amine

INCHI

1S/C24H20F2N4/c25-22-11-19(15-6-3-7-18(8-15)24-28-14-29-30-24)12-23(26)21(22)13-27-20-9-16-4-1-2-5-17(16)10-20/h1-8,11-12,14,20,27H,9-10,13H2,(H,28,29,30)

InChi Key

WIEDUMBCZQRGSY-UHFFFAOYSA-N

Smiles

C1C(CC2=CC=CC=C21)NCC3=C(C=C(C=C3F)C4=CC(=CC=C4)C5=NC=NN5)F

关联CAS

1007573-18-3；1007578-24-6；1426543-84-1

MeSH Entry Terms

GSK 1521498;GSK-1521498;GSK1521498;N-((3,5-difluoro-3'-(1H-1,2,4-triazol-3-yl)-4-biphenylyl)methyl)-2,3-dihydro-1H-inden-2-amine

溶解性

DMSO : 11.36 mg/mL (28.23 mM; ultrasonic and warming and heat to 60°C)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

402.166 Da

单同位素质量Monoisotopic Mass

402.166 Da

拓扑极表面积Topological Polar Surface Area

53.600 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

537.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

4.900

ALogP

4.9

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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