ChemSpider 2D Image | N-{2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-5-(1-naphthyl)-1,2,4-triazin-3-amine | C18H16N6S2

N-{2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-5-(1-naphthyl)-1,2,4-triazin-3-amine

  • Molecular FormulaC18H16N6S2
  • Average mass380.490 Da
  • Monoisotopic mass380.087799 Da
  • ChemSpider ID22147327

More details:

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

1,2,4-Triazin-3-amine, N-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethyl]-5-(1-naphthalenyl)- [ACD/Index Name]
N-{2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-5-(1-naphthyl)-1,2,4-triazin-3-amin [German] [ACD/IUPAC Name]
N-{2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-5-(1-naphthyl)-1,2,4-triazin-3-amine [ACD/IUPAC Name]
N-{2-[(5-Méthyl-1,3,4-thiadiazol-2-yl)sulfanyl]éthyl}-5-(1-naphtyl)-1,2,4-triazin-3-amine [French] [ACD/IUPAC Name]
N-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethyl}-5-(1-naphthyl)-1,2,4-triazin-3-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 634.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.2±34.3 °C
Index of Refraction: 1.727
Molar Refractivity: 106.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 353.24
ACD/KOC (pH 5.5): 2318.40
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 354.17
ACD/KOC (pH 7.4): 2324.50
Polar Surface Area: 130 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 86.6±5.0 dyne/cm
Molar Volume: 267.5±5.0 cm3

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