ChemSpider 2D Image | 1-(4-{5-[5-Amino-6-(1H-benzotriazol-1-yl)-2-pyrazinyl]-1-methyl-1H-pyrazol-3-yl}-1-piperidinyl)-2-(dimethylamino)ethanone | C23H28N10O

1-(4-{5-[5-Amino-6-(1H-benzotriazol-1-yl)-2-pyrazinyl]-1-methyl-1H-pyrazol-3-yl}-1-piperidinyl)-2-(dimethylamino)ethanone

  • Molecular FormulaC23H28N10O
  • Average mass460.535 Da
  • Monoisotopic mass460.244751 Da
  • ChemSpider ID58978406

More details:

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

1-(4-{5-[5-Amino-6-(1H-benzotriazol-1-yl)-2-pyrazinyl]-1-methyl-1H-pyrazol-3-yl}-1-piperidinyl)-2-(dimethylamino)ethanon [German] [ACD/IUPAC Name]
1-(4-{5-[5-Amino-6-(1H-benzotriazol-1-yl)-2-pyrazinyl]-1-methyl-1H-pyrazol-3-yl}-1-piperidinyl)-2-(dimethylamino)ethanone [ACD/IUPAC Name]
1-(4-{5-[5-Amino-6-(1H-benzotriazol-1-yl)-2-pyrazinyl]-1-méthyl-1H-pyrazol-3-yl}-1-pipéridinyl)-2-(diméthylamino)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[5-[5-amino-6-(1H-1,2,3-benzotriazol-1-yl)-2-pyrazinyl]-1-methyl-1H-pyrazol-3-yl]-1-piperidinyl]-2-(dimethylamino)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 724.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 391.7±35.7 °C
Index of Refraction: 1.746
Molar Refractivity: 129.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.68
ACD/LogD (pH 5.5): -1.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.41
Polar Surface Area: 124 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 62.4±7.0 dyne/cm
Molar Volume: 318.0±7.0 cm3

Click to predict properties on the Chemicalize site


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