ChemSpider 2D Image | N-[4-Methyl-3-(4-morpholinylsulfonyl)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide | C30H33N5O4S2

N-[4-Methyl-3-(4-morpholinylsulfonyl)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide

  • Molecular FormulaC30H33N5O4S2
  • Average mass591.744 Da
  • Monoisotopic mass591.197388 Da
  • ChemSpider ID4026215

More details:

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

N-[4-Methyl-3-(4-morpholinylsulfonyl)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamid [German] [ACD/IUPAC Name]
N-[4-Methyl-3-(4-morpholinylsulfonyl)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide [ACD/IUPAC Name]
N-[4-Méthyl-3-(4-morpholinylsulfonyl)phényl]-2-{[5-(3-méthylphényl)-4-(4-méthylphényl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]- [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: 1.664
Molar Refractivity: 164.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8120.23
ACD/KOC (pH 5.5): 21880.43
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8120.39
ACD/KOC (pH 7.4): 21880.87
Polar Surface Area: 140 Å2
Polarizability: 65.1±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 442.9±7.0 cm3

Click to predict properties on the Chemicalize site


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