ChemSpider 2D Image | 5-Nitro-N-[1-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazol-4-yl]-1,3-thiazol-2-amine | C13H14N8O2S

5-Nitro-N-[1-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazol-4-yl]-1,3-thiazol-2-amine

  • Molecular FormulaC13H14N8O2S
  • Average mass346.368 Da
  • Monoisotopic mass346.096039 Da
  • ChemSpider ID60539161

More details:

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

2-Thiazolamine, 5-nitro-N-[1-[(5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyridin-3-yl)methyl]-1H-pyrazol-4-yl]- [ACD/Index Name]
5-Nitro-N-[1-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazol-4-yl]-1,3-thiazol-2-amin [German] [ACD/IUPAC Name]
5-Nitro-N-[1-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazol-4-yl]-1,3-thiazol-2-amine [ACD/IUPAC Name]
5-Nitro-N-[1-(5,6,7,8-tétrahydro[1,2,4]triazolo[4,3-a]pyridin-3-ylméthyl)-1H-pyrazol-4-yl]-1,3-thiazol-2-amine [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 653.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 348.8±34.3 °C
Index of Refraction: 1.889
Molar Refractivity: 88.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.45
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 4.50
ACD/KOC (pH 5.5): 102.01
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 4.52
ACD/KOC (pH 7.4): 102.47
Polar Surface Area: 148 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 93.2±7.0 dyne/cm
Molar Volume: 192.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement