Found 10 results

Search term: MF = 'C_{38}H_{36}F_{2}N_{4}O_{4}'
ChemSpider 2D Image | 2-[6-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)-2-(4-fluorophenyl)-4-pyrimidinyl]-1-(3-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline | C38H36F2N4O4

2-[6-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)-2-(4-fluorophenyl)-4-pyrimidinyl]-1-(3-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

  • Molecular FormulaC38H36F2N4O4
  • Average mass650.714 Da
  • Monoisotopic mass650.270447 Da
  • ChemSpider ID121949790

More details:

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

2-[6-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isochinolinyl)-2-(4-fluorphenyl)-4-pyrimidinyl]-1-(3-fluorphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisochinolin [German] [ACD/IUPAC Name]
2-[6-(6,7-Diméthoxy-3,4-dihydro-2(1H)-isoquinoléinyl)-2-(4-fluorophényl)-4-pyrimidinyl]-1-(3-fluorophényl)-6,7-diméthoxy-1,2,3,4-tétrahydroisoquinoléine [French] [ACD/IUPAC Name]
2-[6-(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)-2-(4-fluorophenyl)-4-pyrimidinyl]-1-(3-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline [ACD/IUPAC Name]
Isoquinoline, 2-[6-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)-2-(4-fluorophenyl)-4-pyrimidinyl]-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-6,7-dimethoxy- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 728.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.4±3.0 kJ/mol
Flash Point: 394.6±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 178.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.56
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 1943.56
ACD/KOC (pH 5.5): 3097.32
ACD/LogD (pH 7.4): 6.37
ACD/BCF (pH 7.4): 38201.96
ACD/KOC (pH 7.4): 60879.83
Polar Surface Area: 69 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 513.9±3.0 cm3

Click to predict properties on the Chemicalize site


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