ChemSpider 2D Image | 3-{1-[(5-Chloro-1-methyl-1H-benzimidazol-2-yl)methyl]-4-piperidinyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine | C19H24ClN7

3-{1-[(5-Chloro-1-methyl-1H-benzimidazol-2-yl)methyl]-4-piperidinyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine

  • Molecular FormulaC19H24ClN7
  • Average mass385.894 Da
  • Monoisotopic mass385.178162 Da
  • ChemSpider ID63799629

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2,4-Triazolo[4,3-a]pyrazine, 3-[1-[(5-chloro-1-methyl-1H-benzimidazol-2-yl)methyl]-4-piperidinyl]-5,6,7,8-tetrahydro- [ACD/Index Name]
3-{1-[(5-Chlor-1-methyl-1H-benzimidazol-2-yl)methyl]-4-piperidinyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin [German] [ACD/IUPAC Name]
3-{1-[(5-Chloro-1-methyl-1H-benzimidazol-2-yl)methyl]-4-piperidinyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine [ACD/IUPAC Name]
3-{1-[(5-Chloro-1-méthyl-1H-benzimidazol-2-yl)méthyl]-4-pipéridinyl}-5,6,7,8-tétrahydro[1,2,4]triazolo[4,3-a]pyrazine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 640.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 341.3±34.3 °C
Index of Refraction: 1.767
Molar Refractivity: 105.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.31
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.03
ACD/KOC (pH 7.4): 192.46
Polar Surface Area: 64 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 62.0±7.0 dyne/cm
Molar Volume: 255.4±7.0 cm3

Click to predict properties on the Chemicalize site


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