Found 9 results

Search term: MF = 'C_{24}H_{26}Cl_{3}N_{3}O_{2}S'
ChemSpider 2D Image | 3,4-Dichloro-N-[1-(8-chloro-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinolin-2-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]benzamide | C24H26Cl3N3O2S

3,4-Dichloro-N-[1-(8-chloro-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinolin-2-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]benzamide

  • Molecular FormulaC24H26Cl3N3O2S
  • Average mass526.906 Da
  • Monoisotopic mass525.081116 Da
  • ChemSpider ID122011626

More details:

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

3,4-Dichlor-N-[1-(8-chlor-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isochinolin-2-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]benzamid [German] [ACD/IUPAC Name]
3,4-Dichloro-N-[1-(8-chloro-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoléin-2-yl)-4-(méthylsulfanyl)-1-oxo-2-butanyl]benzamide [French] [ACD/IUPAC Name]
3,4-Dichloro-N-[1-(8-chloro-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinolin-2-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]benzamide [ACD/IUPAC Name]
Benzamide, 3,4-dichloro-N-[1-[(8-chloro-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinolin-2-yl)carbonyl]-3-(methylthio)propyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 695.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.6±31.5 °C
Index of Refraction: 1.664
Molar Refractivity: 137.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.01
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 1154.19
ACD/KOC (pH 5.5): 2860.94
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 9840.35
ACD/KOC (pH 7.4): 24391.79
Polar Surface Area: 78 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 64.9±5.0 dyne/cm
Molar Volume: 369.4±5.0 cm3

Click to predict properties on the Chemicalize site


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