ChemSpider 2D Image | N-Allyl-N-(1,1-dioxidotetrahydro-3-thiophenyl)-2-{5-[(4-methyl-1-piperidinyl)methyl]-1-tetrazolidinyl}acetamide | C17H32N6O3S

N-Allyl-N-(1,1-dioxidotetrahydro-3-thiophenyl)-2-{5-[(4-methyl-1-piperidinyl)methyl]-1-tetrazolidinyl}acetamide

  • Molecular FormulaC17H32N6O3S
  • Average mass400.539 Da
  • Monoisotopic mass400.225647 Da
  • ChemSpider ID110196471

More details:

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

1-Tetrazolidineacetamide, 5-[(4-methyl-1-piperidinyl)methyl]-N-2-propen-1-yl-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
N-Allyl-N-(1,1-dioxidotetrahydro-3-thiophenyl)-2-{5-[(4-methyl-1-piperidinyl)methyl]-1-tetrazolidinyl}acetamid [German] [ACD/IUPAC Name]
N-Allyl-N-(1,1-dioxidotetrahydro-3-thiophenyl)-2-{5-[(4-methyl-1-piperidinyl)methyl]-1-tetrazolidinyl}acetamide [ACD/IUPAC Name]
N-Allyl-N-(1,1-dioxydotétrahydro-3-thiophényl)-2-{5-[(4-méthyl-1-pipéridinyl)méthyl]-1-tétrazolidinyl}acétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 585.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 308.1±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 105.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.61
ACD/LogD (pH 5.5): -3.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 59.5±5.0 dyne/cm
Molar Volume: 307.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement