ChemSpider 2D Image | 4-Methoxy-6-(4-methoxyphenyl)-1H-pyrimido[4,5-b][1,4]benzodiazepin-2-amine | C19H17N5O2

4-Methoxy-6-(4-methoxyphenyl)-1H-pyrimido[4,5-b][1,4]benzodiazepin-2-amine

  • Molecular FormulaC19H17N5O2
  • Average mass347.371 Da
  • Monoisotopic mass347.138214 Da
  • ChemSpider ID30654135

More details:

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

11H-Pyrimido[4,5-b][1,4]benzodiazepin-2-amine, 4-methoxy-6-(4-methoxyphenyl)- [ACD/Index Name]
4-Methoxy-6-(4-methoxyphenyl)-1H-pyrimido[4,5-b][1,4]benzodiazepin-2-amin [German] [ACD/IUPAC Name]
4-Methoxy-6-(4-methoxyphenyl)-1H-pyrimido[4,5-b][1,4]benzodiazepin-2-amine [ACD/IUPAC Name]
4-Méthoxy-6-(4-méthoxyphényl)-1H-pyrimido[4,5-b][1,4]benzodiazépin-2-amine [French] [ACD/IUPAC 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: 601.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 317.5±34.3 °C
Index of Refraction: 1.694
Molar Refractivity: 96.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 95.75
ACD/KOC (pH 5.5): 804.78
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 147.29
ACD/KOC (pH 7.4): 1238.06
Polar Surface Area: 95 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 251.2±7.0 cm3

Click to predict properties on the Chemicalize site


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