ChemSpider 2D Image | 2-[1-(1-Methyl-1H-pyrazol-4-yl)-3-(3-methyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-d][1,4]diazepine | C17H20N10

2-[1-(1-Methyl-1H-pyrazol-4-yl)-3-(3-methyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-d][1,4]diazepine

  • Molecular FormulaC17H20N10
  • Average mass364.408 Da
  • Monoisotopic mass364.187256 Da
  • ChemSpider ID103851385

More details:

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

2-[1-(1-Methyl-1H-pyrazol-4-yl)-3-(3-methyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-d][1,4]diazepin [German] [ACD/IUPAC Name]
2-[1-(1-Methyl-1H-pyrazol-4-yl)-3-(3-methyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-d][1,4]diazepine [ACD/IUPAC Name]
2-[1-(1-Méthyl-1H-pyrazol-4-yl)-3-(3-méthyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]-6,7,8,9-tétrahydro-5H-imidazo[1,2-d][1,4]diazépine [French] [ACD/IUPAC Name]
5H-Imidazo[1,2-d][1,4]diazepine, 6,7,8,9-tetrahydro-2-[1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methyl-1H-pyrazol-4-yl)-1H-1,2,4-triazol-5-yl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 784.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 428.3±35.7 °C
Index of Refraction: 1.844
Molar Refractivity: 101.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 1.23
ACD/LogD (pH 5.5): -1.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.64
Polar Surface Area: 107 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 72.2±7.0 dyne/cm
Molar Volume: 227.2±7.0 cm3

Click to predict properties on the Chemicalize site


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