ChemSpider 2D Image | N-Cyclopropyl-7-(2-pyrazinyl)-2-(4-pyridinyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine | C20H21N7

N-Cyclopropyl-7-(2-pyrazinyl)-2-(4-pyridinyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine

  • Molecular FormulaC20H21N7
  • Average mass359.428 Da
  • Monoisotopic mass359.185852 Da
  • ChemSpider ID29535525

More details:

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

5H-Pyrimido[4,5-d]azepin-4-amine, N-cyclopropyl-6,7,8,9-tetrahydro-7-(2-pyrazinyl)-2-(4-pyridinyl)- [ACD/Index Name]
N-Cyclopropyl-7-(2-pyrazinyl)-2-(4-pyridinyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amin [German] [ACD/IUPAC Name]
N-Cyclopropyl-7-(2-pyrazinyl)-2-(4-pyridinyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine [ACD/IUPAC Name]
N-Cyclopropyl-7-(2-pyrazinyl)-2-(4-pyridinyl)-6,7,8,9-tétrahydro-5H-pyrimido[4,5-d]azépin-4-amine [French] [ACD/IUPAC Name]
N-cyclopropyl-7-pyrazin-2-yl-2-pyridin-4-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 549.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 286.2±30.1 °C
Index of Refraction: 1.689
Molar Refractivity: 102.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 18.83
ACD/KOC (pH 5.5): 278.60
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.27
ACD/KOC (pH 7.4): 299.93
Polar Surface Area: 80 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 76.9±3.0 dyne/cm
Molar Volume: 269.4±3.0 cm3

Click to predict properties on the Chemicalize site


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