Found 117 results

Search term: MF = 'C_{13}H_{16}N_{4}OS_{3}'
ChemSpider 2D Image | 6-{[5-(Butylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-methylnicotinamide | C13H16N4OS3

6-{[5-(Butylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-methylnicotinamide

  • Molecular FormulaC13H16N4OS3
  • Average mass340.487 Da
  • Monoisotopic mass340.048615 Da
  • ChemSpider ID22442081

More details:

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

3-Pyridinecarboxamide, 6-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-N-methyl- [ACD/Index Name]
6-{[5-(Butylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-methylnicotinamid [German] [ACD/IUPAC Name]
6-{[5-(Butylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-methylnicotinamide [ACD/IUPAC Name]
6-{[5-(Butylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-méthylnicotinamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.648
Molar Refractivity: 90.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.70
ACD/KOC (pH 5.5): 806.43
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.70
ACD/KOC (pH 7.4): 806.43
Polar Surface Area: 147 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 71.5±5.0 dyne/cm
Molar Volume: 249.0±5.0 cm3

Click to predict properties on the Chemicalize site


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