Found 314 results

Search term: MF = 'C_{13}H_{19}N_{5}S_{2}'
ChemSpider 2D Image | 4-Methyl-2-{[4-(3-thienylmethyl)-1-piperazinyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione | C13H19N5S2

4-Methyl-2-{[4-(3-thienylmethyl)-1-piperazinyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione

  • Molecular FormulaC13H19N5S2
  • Average mass309.453 Da
  • Monoisotopic mass309.108185 Da
  • ChemSpider ID22822244

More details:

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

3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-2-[[4-(3-thienylmethyl)-1-piperazinyl]methyl]- [ACD/Index Name]
4-Methyl-2-{[4-(3-thienylmethyl)-1-piperazinyl]methyl}-2,4-dihydro-3H-1,2,4-triazol-3-thion [German] [ACD/IUPAC Name]
4-Methyl-2-{[4-(3-thienylmethyl)-1-piperazinyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione [ACD/IUPAC Name]
4-Méthyl-2-{[4-(3-thiénylméthyl)-1-pipérazinyl]méthyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione [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: 407.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.5±31.5 °C
Index of Refraction: 1.711
Molar Refractivity: 88.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.44
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.67
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.10
ACD/KOC (pH 7.4): 35.52
Polar Surface Area: 86 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 226.6±7.0 cm3

Click to predict properties on the Chemicalize site


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