ChemSpider 2D Image | N-(4-Methylphenyl)-5-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide | C13H13N7OS2

N-(4-Methylphenyl)-5-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide

  • Molecular FormulaC13H13N7OS2
  • Average mass347.419 Da
  • Monoisotopic mass347.062286 Da
  • ChemSpider ID21752674

More details:

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

1,3,4-Thiadiazole-2-carboxamide, N-(4-methylphenyl)-5-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]- [ACD/Index Name]
N-(4-Methylphenyl)-5-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,3,4-thiadiazol-2-carboxamid [German] [ACD/IUPAC Name]
N-(4-Methylphenyl)-5-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide [ACD/IUPAC Name]
N-(4-Méthylphényl)-5-{[(1-méthyl-1H-tétrazol-5-yl)sulfanyl]méthyl}-1,3,4-thiadiazole-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.790
Molar Refractivity: 93.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.40
ACD/KOC (pH 5.5): 131.38
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.38
ACD/KOC (pH 7.4): 131.10
Polar Surface Area: 152 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 69.1±7.0 dyne/cm
Molar Volume: 220.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement