ChemSpider 2D Image | 6-Ethyl-3-{[1-(2-furylmethyl)-1H-tetrazol-5-yl][4-(4-methoxyphenyl)-1-piperazinyl]methyl}-2(1H)-quinolinone | C29H31N7O3

6-Ethyl-3-{[1-(2-furylmethyl)-1H-tetrazol-5-yl][4-(4-methoxyphenyl)-1-piperazinyl]methyl}-2(1H)-quinolinone

  • Molecular FormulaC29H31N7O3
  • Average mass525.602 Da
  • Monoisotopic mass525.248840 Da
  • ChemSpider ID2446990

More details:

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

2(1H)-Quinolinone, 6-ethyl-3-[[1-(2-furanylmethyl)-1H-tetrazol-5-yl][4-(4-methoxyphenyl)-1-piperazinyl]methyl]- [ACD/Index Name]
6-Ethyl-3-{[1-(2-furylmethyl)-1H-tetrazol-5-yl][4-(4-methoxyphenyl)-1-piperazinyl]methyl}-2(1H)-chinolinon [German] [ACD/IUPAC Name]
6-Éthyl-3-{[1-(2-furylméthyl)-1H-tétrazol-5-yl][4-(4-méthoxyphényl)-1-pipérazinyl]méthyl}-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
6-Ethyl-3-{[1-(2-furylmethyl)-1H-tetrazol-5-yl][4-(4-methoxyphenyl)-1-piperazinyl]methyl}-2(1H)-quinolinone [ACD/IUPAC Name]

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

ASN 05214019 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 791.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.2±3.0 kJ/mol
Flash Point: 432.7±32.9 °C
Index of Refraction: 1.691
Molar Refractivity: 148.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 2.39
ACD/BCF (pH 5.5): 18.91
ACD/KOC (pH 5.5): 122.49
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 296.78
ACD/KOC (pH 7.4): 1922.83
Polar Surface Area: 102 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 387.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement