ChemSpider 2D Image | 4-Isopropoxy-2-(4-{6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl}-1-piperazinyl)benzamide | C31H42N6O4

4-Isopropoxy-2-(4-{6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl}-1-piperazinyl)benzamide

  • Molecular FormulaC31H42N6O4
  • Average mass562.703 Da
  • Monoisotopic mass562.326782 Da
  • ChemSpider ID30689683

More details:

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

4-Isopropoxy-2-(4-{6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-chinazolinyl}-1-piperazinyl)benzamid [German] [ACD/IUPAC Name]
4-Isopropoxy-2-(4-{6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl}-1-piperazinyl)benzamide [ACD/IUPAC Name]
4-Isopropoxy-2-(4-{6-méthoxy-7-[3-(1-pipéridinyl)propoxy]-4-quinazolinyl}-1-pipérazinyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[4-[6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl]-1-piperazinyl]-4-(1-methylethoxy)- [ACD/Index Name]
[4-[6-Methoxy-7-(3-piperidylpropoxy)quinazolin-4-yl]piperazinyl]-N-[4-(methylethoxy)phenyl]carboxamide
2-(4-{6-METHOXY-7-[3-(PIPERIDIN-1-YL)PROPOXY]QUINAZOLIN-4-YL}PIPERAZIN-1-YL)-4-(PROPAN-2-YLOXY)BENZAMIDE
387867-13-2 [RN]
4-ISOPROPOXY-2-(4-{6-METHOXY-7-[3-(PIPERIDIN-1-YL)PROPOXY]QUINAZOLIN-4-YL}PIPERAZIN-1-YL)BENZAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 747.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 405.9±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 160.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.45
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 106 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 468.2±3.0 cm3

Click to predict properties on the Chemicalize site


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