ChemSpider 2D Image | N-{[7-(Methylsulfanyl)-2-(4-morpholinyl)-3-quinolinyl]methyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophenecarboxamide | C27H32N4O3S2

N-{[7-(Methylsulfanyl)-2-(4-morpholinyl)-3-quinolinyl]methyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophenecarboxamide

  • Molecular FormulaC27H32N4O3S2
  • Average mass524.698 Da
  • Monoisotopic mass524.191589 Da
  • ChemSpider ID22154049

More details:

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

2-Thiophenecarboxamide, N-[[7-(methylthio)-2-(4-morpholinyl)-3-quinolinyl]methyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]- [ACD/Index Name]
N-{[7-(Methylsulfanyl)-2-(4-morpholinyl)-3-chinolinyl]methyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-{[7-(Méthylsulfanyl)-2-(4-morpholinyl)-3-quinoléinyl]méthyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
N-{[7-(Methylsulfanyl)-2-(4-morpholinyl)-3-quinolinyl]methyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophenecarboxamide [ACD/IUPAC Name]
N-{[7-(methylthio)-2-(4-morpholinyl)-3-quinolinyl]methyl}-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-thiophenecarboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 793.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.4±3.0 kJ/mol
Flash Point: 433.8±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 147.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 215.47
ACD/KOC (pH 5.5): 1461.00
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 314.00
ACD/KOC (pH 7.4): 2129.05
Polar Surface Area: 120 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 70.1±5.0 dyne/cm
Molar Volume: 388.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement