Identification |
Name: | 4H-Isoindol-4-one,octahydro-2-[1-imino-2-(2-methoxyphenyl)ethyl]-7,7-diphenyl-, (3aR,7aR)- |
Synonyms: | (3aR,7aR)-Octahydro-2-[1-imino-2-(2-methoxyphenyl)ethyl]-7,7-diphenyl-4H-isoindol;RP67580; |
CAS: | 135911-02-3 |
Molecular Formula: | C29H30N2O2 |
Molecular Weight: | 438.5607 |
InChI: | InChI=1S/C29H30N2O2/c1-33-27-15-9-8-10-21(27)18-28(30)31-19-24-25(20-31)29(17-16-26(24)32,22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-15,24-25,30H,16-20H2,1H3/t24-,25+/m0/s1 |
Molecular Structure: |
|
Properties |
Melting Point: | 195-188ºC |
Flash Point: | 309.7 ºC |
Boiling Point: | 588.5 ºC at 760 mmHg |
Density: | 1.17 g/cm3 |
Refractive index: | 1.626 |
Water Solubility: | Soluble to 100 mM in Ethanol and to 50 mM in DMSO |
Solubility: | Soluble to 100 mM in Ethanol and to 50 mM in DMSO |
Appearance: | White Solid |
Biological Activity: | Potent and selective tachykinin NK 1 receptor antagonist (K i values are 2.9 nM and > 10 μ M for rat NK 1 , and rat NK 2 and NK 3 receptors respectively). Displays higher affinity at rat and mouse than human receptors. Antinociceptive in vivo , possibly partly via inhibition of calcium channels. |
Flash Point: | 309.7 ºC |
Safety Data |
|
|