ChemSpider 2D Image | N-{4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butyl}-4-[1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]butanamide | C26H31Cl2N7O3

N-{4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butyl}-4-[1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]butanamide

  • Molecular FormulaC26H31Cl2N7O3
  • Average mass560.475 Da
  • Monoisotopic mass559.186523 Da
  • ChemSpider ID24634860

More details:

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

1H-1,2,3-Triazole-4-butanamide, N-[4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butyl]-1-(4-nitrophenyl)- [ACD/Index Name]
N-{4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butyl}-4-[1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]butanamide [ACD/IUPAC Name]
N-{4-[4-(2,3-Dichlorophényl)-1-pipérazinyl]butyl}-4-[1-(4-nitrophényl)-1H-1,2,3-triazol-4-yl]butanamide [French] [ACD/IUPAC Name]
N-{4-[4-(2,3-Dichlorphenyl)-1-piperazinyl]butyl}-4-[1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]butanamid [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.658
Molar Refractivity: 148.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 5.08
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 66.36
ACD/KOC (pH 5.5): 224.82
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2127.09
ACD/KOC (pH 7.4): 7206.62
Polar Surface Area: 112 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 56.8±7.0 dyne/cm
Molar Volume: 404.2±7.0 cm3

Click to predict properties on the Chemicalize site


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