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Search term: ZWPGIWZXXUHJCV-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-[2-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]-2-(3-propylphenyl)-4(3H)-quinazolinone | C30H33N3O3

3-[2-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]-2-(3-propylphenyl)-4(3H)-quinazolinone

  • Molecular FormulaC30H33N3O3
  • Average mass483.601 Da
  • Monoisotopic mass483.252197 Da
  • ChemSpider ID23225319

More details:

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

3-[2-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isochinolinyl)ethyl]-2-(3-propylphenyl)-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-[2-(6,7-Diméthoxy-3,4-dihydro-2(1H)-isoquinoléinyl)éthyl]-2-(3-propylphényl)-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
3-[2-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]-2-(3-propylphenyl)-4(3H)-quinazolinone [ACD/IUPAC Name]
3-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-2-(3-propylphenyl)quinazolin-4(3H)-one
4(3H)-Quinazolinone, 3-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]-2-(3-propylphenyl)- [ACD/Index Name]
3-[2-(6,7-Dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-ethyl]-2-(3-propyl-phenyl)-3H-quinazolin-4-one
CHEMBL152590

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

Density: 1.2±0.1 g/cm3
Boiling Point: 651.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.0±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 142.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.70
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 1.41
ACD/KOC (pH 5.5): 7.77
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 64.36
ACD/KOC (pH 7.4): 354.76
Polar Surface Area: 54 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 406.3±7.0 cm3

Click to predict properties on the Chemicalize site


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