Product Name

  • Name

    SB 239063

  • EINECS
  • CAS No. 193551-21-2
  • Article Data3
  • CAS DataBase
  • Density 1.35g/cm3
  • Solubility
  • Melting Point 206-207.2?°C
  • Formula C20H21FN4O2
  • Boiling Point 594.8°C at 760 mmHg
  • Molecular Weight 368.411
  • Flash Point 313.5°C
  • Transport Information
  • Appearance
  • Safety A poison by ingestion. When heated to decomposition it emits toxic vapors of NOx and F.
  • Risk Codes
  • Molecular Structure Molecular Structure of 193551-21-2 (SB 239063)
  • Hazard Symbols A poison by ingestion.
  • Synonyms Tocris-1962;Kinome_3168;trans-1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypyridimidin-4-yl)imidazole;
  • PSA 73.06000
  • LogP 3.63080

SB-239063 Chemical Properties

IUPAC Name: trans-4-(4-Fluorophenyl)-1-(4-hydroxycyclohexyl)-5-(2-methoxypyrimidin-4-yl)imidazole
Molecular Formula: C20H21FN4O2
Molecular Weight: 368.41
Freely Rotating Bonds: 5
Polar Surface Area: 73.06 Å2
Index of Refraction: 1.655
Molar Refractivity: 99.56 cm3
Molar Volume: 271.1 cm3
Polarizability: 39.47 ×10-24 cm3
Surface Tension: 49.2 dyne/cm
Density: 1.35 g/cm3
Flash Point: 313.5 °C
Enthalpy of Vaporization: 93.22 kJ/mol
Boiling Point: 594.8 °C at 760 mmHg
Vapour Pressure: 5.42E-15 mmHg at 25°C 
The Cas Register Number of  trans-1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypy-rimidin-4-yl)imidazole is 193551-21-2.The chemical synonyms of trans-1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypy-rimidin-4-yl)imidazole (CAS NO.193551-21-2) are cyclohexanol, 4-[4-(4-fluorophenyl)-5-(2-methoxy-4-pyrimidinyl)-1H-imidazol-1-yl]-, trans- ; trans-4-[4-(4-Fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1H-imidazol-1-yl]cyclohexanol ; 193551-21-2 [RN] ; 4-[4-(4-Fluoro-phenyl)-5-(2-methoxy-pyrimidin-4-yl)-imidazol-1-yl]-cyclohexanol ; trans -1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)imidazole  and  trans-4-[4-(4-Fluorophenyl)-5-(2-methoxy-4-pyrimidinyl)-1H-imidazol-1-yl]cyclohexanol . The molecular structure of trans-1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypy-rimidin-4-yl)imidazole (CAS NO.193551-21-2) is.

SB-239063 Uses

 trans-1-(4-Hydroxycyclohexyl)-4-(4-fluorophenyl)-5-(2-methoxypy-rimidin-4-yl)imidazole (CAS NO.193551-21-2) is used as pharmaceutical intermediate.

SB-239063 Production

 
The condensation of p- fluorobenzaldehyde (I) with p-toluenesulfinic acid (II) in the presence of camphorsulfonic acid in formamide produced the tosylmethyl formamide (III). This was dehydrated to the required isocyanide (IV) using POCl3 and Et3N in cold dimethoxyethane

SB-239063 Toxicity Data With Reference

1.    

orl-mus TDLo:2.5 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 293 (2000),281.
2.    

orl-gpg TDLo:10 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 293 (2000),281.

SB-239063 Safety Profile

A poison by ingestion. When heated to decomposition it emits toxic vapors of NOx and F.
Safety Statements: 22-24/25 
S22: Do not breathe dust. 
S24/25: Avoid contact with skin and eyes.
WGK Germany: 3
RTECS: GV9458000

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