ChemicalBook--->CAS DataBase List--->1639220-17-9

1639220-17-9

1639220-17-9 Structure

1639220-17-9 Structure
IdentificationBack Directory
[Name]

Sigma-1 receptor antagonist 3
[CAS]

1639220-17-9
[Synonyms]

Sigma-1 receptor antagonist 3
Pyrimidine, 5-chloro-2-(4-fluorophenyl)-4-methyl-6-[3-(1-piperidinyl)propoxy]-
KcsA,Potassium Channel,inhibit,Sigma-1 receptor antagonist 3,Sigma 1 receptor antagonist 3,Inhibitor,Sigma Receptor,Sigma1 receptor antagonist 3
[Molecular Formula]

C19H23ClFN3O
[MDL Number]

MFCD32215324
[MOL File]

1639220-17-9.mol
[Molecular Weight]

363.86
Chemical PropertiesBack Directory
[Boiling point ]

415.9±45.0 °C(Predicted)
[density ]

1.196±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: 12.5 mg/mL (34.35 mM)
[form ]

Solid
[pka]

8.95±0.10(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

Sigma-1 receptor antagonist 3 (compound135) is a potent and selective Sigma-1 (σ1) receptor antagonist with a Ki of 1.14 nM. Sigma-1 receptor antagonist 3 inhibits Human Ether-a-go-go-Related Gene (hERG) with an IC50 of 1.54 μM. Sigma-1 receptor antagonist 3 has the potential for the neuropathic pain[1].
[IC 50]

Sigma 1 Receptor
[References]

[1] Lan Y, et al. Synthesis and biological evaluation of novel sigma-1 receptor antagonists based on pyrimidine scaffold as agents for treating neuropathic pain. J Med Chem. 2014 Dec 26;57(24):10404-23. DOI:10.1021/jm501207r
Spectrum DetailBack Directory
[Spectrum Detail]

Sigma-1 receptor antagonist 3(1639220-17-9)1HNMR
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