ChemSpider 2D Image | 4-Chloro-2-({6-[1-(2-methoxyphenyl)-3,4-dihydro-2(1H)-isoquinolinyl]-2-phenyl-4-pyrimidinyl}amino)phenol | C32H27ClN4O2

4-Chloro-2-({6-[1-(2-methoxyphenyl)-3,4-dihydro-2(1H)-isoquinolinyl]-2-phenyl-4-pyrimidinyl}amino)phenol

  • Molecular FormulaC32H27ClN4O2
  • Average mass535.035 Da
  • Monoisotopic mass534.182251 Da
  • ChemSpider ID121492798

More details:

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

4-Chlor-2-({6-[1-(2-methoxyphenyl)-3,4-dihydro-2(1H)-isochinolinyl]-2-phenyl-4-pyrimidinyl}amino)phenol [German] [ACD/IUPAC Name]
4-Chloro-2-({6-[1-(2-méthoxyphényl)-3,4-dihydro-2(1H)-isoquinoléinyl]-2-phényl-4-pyrimidinyl}amino)phénol [French] [ACD/IUPAC Name]
4-Chloro-2-({6-[1-(2-methoxyphenyl)-3,4-dihydro-2(1H)-isoquinolinyl]-2-phenyl-4-pyrimidinyl}amino)phenol [ACD/IUPAC Name]
Phenol, 4-chloro-2-[[6-[3,4-dihydro-1-(2-methoxyphenyl)-2(1H)-isoquinolinyl]-2-phenyl-4-pyrimidinyl]amino]- [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: 644.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 343.7±31.5 °C
Index of Refraction: 1.682
Molar Refractivity: 154.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 7.22
ACD/BCF (pH 5.5): 161545.67
ACD/KOC (pH 5.5): 164442.80
ACD/LogD (pH 7.4): 7.38
ACD/BCF (pH 7.4): 236390.78
ACD/KOC (pH 7.4): 240630.16
Polar Surface Area: 71 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 407.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement