ChemSpider 2D Image | 3-[(7R)-5,13-Dioxo-5,6,7,13-tetrahydroquinazolino[3,2-a][1,4]benzodiazepin-7-yl]propanenitrile | C19H14N4O2

3-[(7R)-5,13-Dioxo-5,6,7,13-tetrahydroquinazolino[3,2-a][1,4]benzodiazepin-7-yl]propanenitrile

  • Molecular FormulaC19H14N4O2
  • Average mass330.340 Da
  • Monoisotopic mass330.111664 Da
  • ChemSpider ID44210967

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-[(7R)-5,13-Dioxo-5,6,7,13-tetrahydrochinazolino[3,2-a][1,4]benzodiazepin-7-yl]propannitril [German] [ACD/IUPAC Name]
3-[(7R)-5,13-Dioxo-5,6,7,13-tetrahydroquinazolino[3,2-a][1,4]benzodiazepin-7-yl]propanenitrile [ACD/IUPAC Name]
3-[(7R)-5,13-Dioxo-5,6,7,13-tétrahydroquinazolino[3,2-a][1,4]benzodiazépin-7-yl]propanenitrile [French] [ACD/IUPAC Name]
Quinazolino[3,2-a][1,4]benzodiazepine-7-propanenitrile, 5,6,7,13-tetrahydro-5,13-dioxo-, (7R)- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.724
Molar Refractivity: 93.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.00
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.59
ACD/KOC (pH 5.5): 86.87
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 3.59
ACD/KOC (pH 7.4): 86.86
Polar Surface Area: 86 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 61.6±7.0 dyne/cm
Molar Volume: 235.9±7.0 cm3

Click to predict properties on the Chemicalize site


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