ChemSpider 2D Image | N-[2-({1-[1-(4-Chlorophenyl)cyclobutyl]-1,2,3,4-tetrahydro-7-isoquinolinyl}oxy)ethyl]-3-(4-morpholinyl)-1-propanesulfonamide | C28H38ClN3O4S

N-[2-({1-[1-(4-Chlorophenyl)cyclobutyl]-1,2,3,4-tetrahydro-7-isoquinolinyl}oxy)ethyl]-3-(4-morpholinyl)-1-propanesulfonamide

  • Molecular FormulaC28H38ClN3O4S
  • Average mass548.137 Da
  • Monoisotopic mass547.227173 Da
  • ChemSpider ID58894608

More details:

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

4-Morpholinepropanesulfonamide, N-[2-[[1-[1-(4-chlorophenyl)cyclobutyl]-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy]ethyl]- [ACD/Index Name]
N-[2-({1-[1-(4-Chlorophényl)cyclobutyl]-1,2,3,4-tétrahydro-7-isoquinoléinyl}oxy)éthyl]-3-(4-morpholinyl)-1-propanesulfonamide [French] [ACD/IUPAC Name]
N-[2-({1-[1-(4-Chlorophenyl)cyclobutyl]-1,2,3,4-tetrahydro-7-isoquinolinyl}oxy)ethyl]-3-(4-morpholinyl)-1-propanesulfonamide [ACD/IUPAC Name]
N-[2-({1-[1-(4-Chlorphenyl)cyclobutyl]-1,2,3,4-tetrahydro-7-isochinolinyl}oxy)ethyl]-3-(4-morpholinyl)-1-propansulfonamid [German] [ACD/IUPAC 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: 689.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.0±34.3 °C
Index of Refraction: 1.593
Molar Refractivity: 147.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.63
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 3.69
ACD/KOC (pH 7.4): 23.94
Polar Surface Area: 88 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 436.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement