ChemSpider 2D Image | 1-[(5-Isobutyryl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methyl]-3-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]urea | C20H31N7O2

1-[(5-Isobutyryl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methyl]-3-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]urea

  • Molecular FormulaC20H31N7O2
  • Average mass401.506 Da
  • Monoisotopic mass401.253937 Da
  • ChemSpider ID58209913

More details:

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

1-[(5-Isobutyryl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methyl]-3-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]harnstoff [German] [ACD/IUPAC Name]
1-[(5-Isobutyryl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methyl]-3-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]urea [ACD/IUPAC Name]
1-[(5-Isobutyryl-4,5,6,7-tétrahydropyrazolo[1,5-a]pyrazin-2-yl)méthyl]-3-[1-(1,3,5-triméthyl-1H-pyrazol-4-yl)éthyl]urée [French] [ACD/IUPAC Name]
Urea, N-[[4,5,6,7-tetrahydro-5-(2-methyl-1-oxopropyl)pyrazolo[1,5-a]pyrazin-2-yl]methyl]-N'-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]- [ACD/Index Name]
N-[(5-isobutyryl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methyl]-N'-[1-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]urea

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

Density: 1.3±0.1 g/cm3
Boiling Point: 695.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.5±31.5 °C
Index of Refraction: 1.642
Molar Refractivity: 111.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.81
ACD/KOC (pH 5.5): 53.13
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.81
ACD/KOC (pH 7.4): 53.30
Polar Surface Area: 97 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 309.4±7.0 cm3

Click to predict properties on the Chemicalize site


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