ChemSpider 2D Image | 4-[7-(3-Cyclohexylpropoxy)-6-methoxy-4-quinazolinyl]-N-(4-isopropoxyphenyl)-1-piperazinecarboxamide | C32H43N5O4

4-[7-(3-Cyclohexylpropoxy)-6-methoxy-4-quinazolinyl]-N-(4-isopropoxyphenyl)-1-piperazinecarboxamide

  • Molecular FormulaC32H43N5O4
  • Average mass561.715 Da
  • Monoisotopic mass561.331482 Da
  • ChemSpider ID9214186

More details:

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

1-Piperazinecarboxamide, 4-[7-(3-cyclohexylpropoxy)-6-methoxy-4-quinazolinyl]-N-[4-(1-methylethoxy)phenyl]- [ACD/Index Name]
4-[7-(3-Cyclohexylpropoxy)-6-methoxy-4-chinazolinyl]-N-(4-isopropoxyphenyl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-[7-(3-Cyclohexylpropoxy)-6-methoxy-4-quinazolinyl]-N-(4-isopropoxyphenyl)-1-piperazinecarboxamide [ACD/IUPAC Name]
4-[7-(3-Cyclohexylpropoxy)-6-méthoxy-4-quinazolinyl]-N-(4-isopropoxyphényl)-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
4-[7-(3-cyclohexylpropoxy)-6-methoxyquinazolin-4-yl]-N-[4-(propan-2-yloxy)phenyl]piperazine-1-carboxamide
4-[7-(3-Cyclohexyl-propoxy)-6-methoxy-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide
CHEMBL124439

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

Density: 1.2±0.1 g/cm3
Boiling Point: 750.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 407.9±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 162.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 32.38
ACD/KOC (pH 5.5): 82.34
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 104.08
ACD/KOC (pH 7.4): 264.65
Polar Surface Area: 89 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 472.8±3.0 cm3

Click to predict properties on the Chemicalize site


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