ChemSpider 2D Image | N-{[1-(Methylsulfonyl)-2-piperidinyl]methyl}-4-(4-methyl-4H-1,2,4-triazol-3-yl)-1-piperazinecarboxamide | C15H27N7O3S

N-{[1-(Methylsulfonyl)-2-piperidinyl]methyl}-4-(4-methyl-4H-1,2,4-triazol-3-yl)-1-piperazinecarboxamide

  • Molecular FormulaC15H27N7O3S
  • Average mass385.485 Da
  • Monoisotopic mass385.189606 Da
  • ChemSpider ID64987972

More details:

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

1-Piperazinecarboxamide, N-[[1-(methylsulfonyl)-2-piperidinyl]methyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)- [ACD/Index Name]
N-{[1-(Methylsulfonyl)-2-piperidinyl]methyl}-4-(4-methyl-4H-1,2,4-triazol-3-yl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
N-{[1-(Methylsulfonyl)-2-piperidinyl]methyl}-4-(4-methyl-4H-1,2,4-triazol-3-yl)-1-piperazinecarboxamide [ACD/IUPAC Name]
N-{[1-(Méthylsulfonyl)-2-pipéridinyl]méthyl}-4-(4-méthyl-4H-1,2,4-triazol-3-yl)-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.683
Molar Refractivity: 99.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.18
ACD/LogD (pH 5.5): -1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.60
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.34
Polar Surface Area: 112 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 62.8±7.0 dyne/cm
Molar Volume: 261.6±7.0 cm3

Click to predict properties on the Chemicalize site


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