ChemSpider 2D Image | 2-({5-(Methoxymethyl)-4-[(E)-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]benzylidene}amino]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-propylacetamide | C23H34N6O5S

2-({5-(Methoxymethyl)-4-[(E)-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]benzylidene}amino]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-propylacetamide

  • Molecular FormulaC23H34N6O5S
  • Average mass506.618 Da
  • Monoisotopic mass506.231140 Da
  • ChemSpider ID126604709
  • Double-bond stereo - Double-bond stereo


More details:






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

2-({5-(Methoxymethyl)-4-[(E)-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]benzyliden}amino]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-propylacetamid [German] [ACD/IUPAC Name]
2-({5-(Methoxymethyl)-4-[(E)-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]benzylidene}amino]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-propylacetamide [ACD/IUPAC Name]
2-({5-(Méthoxyméthyl)-4-[(E)-{3-méthoxy-4-[2-(4-morpholinyl)éthoxy]benzylidène}amino]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-propylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[5-(methoxymethyl)-4-[[(1E)-[3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl]methylene]amino]-4H-1,2,4-triazol-3-yl]thio]-N-propyl- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.602
Molar Refractivity: 134.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.59
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.32
ACD/KOC (pH 7.4): 141.12
Polar Surface Area: 138 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 392.4±7.0 cm3

Click to predict properties on the Chemicalize site






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