ChemSpider 2D Image | N-(2-Methoxyphenyl)-5-({[2-(3-thienyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-amine | C17H14N4OS4

N-(2-Methoxyphenyl)-5-({[2-(3-thienyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-amine

  • Molecular FormulaC17H14N4OS4
  • Average mass418.579 Da
  • Monoisotopic mass418.005035 Da
  • ChemSpider ID78396665

More details:

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

1,3,4-Thiadiazol-2-amine, N-(2-methoxyphenyl)-5-[[[2-(3-thienyl)-4-thiazolyl]methyl]thio]- [ACD/Index Name]
N-(2-Methoxyphenyl)-5-({[2-(3-thienyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-amin [German] [ACD/IUPAC Name]
N-(2-Methoxyphenyl)-5-({[2-(3-thienyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-amine [ACD/IUPAC Name]
N-(2-Méthoxyphényl)-5-({[2-(3-thiényl)-1,3-thiazol-4-yl]méthyl}sulfanyl)-1,3,4-thiadiazol-2-amine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 627.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 333.2±34.3 °C
Index of Refraction: 1.735
Molar Refractivity: 111.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3414.41
ACD/KOC (pH 5.5): 11768.86
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3414.60
ACD/KOC (pH 7.4): 11769.51
Polar Surface Area: 170 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 84.7±5.0 dyne/cm
Molar Volume: 277.6±5.0 cm3

Click to predict properties on the Chemicalize site


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