ChemSpider 2D Image | N-Cyclopentyl-4-{[6-(3-fluorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl}-1-piperazinecarboxamide | C22H29FN6O2

N-Cyclopentyl-4-{[6-(3-fluorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl}-1-piperazinecarboxamide

  • Molecular FormulaC22H29FN6O2
  • Average mass428.503 Da
  • Monoisotopic mass428.233612 Da
  • ChemSpider ID35302181

More details:

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

1-Piperazinecarboxamide, N-cyclopentyl-4-[[6-(3-fluorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl]- [ACD/Index Name]
N-Cyclopentyl-4-{[6-(3-fluorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl}-1-piperazinecarboxamide [ACD/IUPAC Name]
N-Cyclopentyl-4-{[6-(3-fluorophényl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]méthyl}-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
N-Cyclopentyl-4-{[6-(3-fluorphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl}-1-piperazincarboxamid [German] [ACD/IUPAC Name]
N-cyclopentyl-4-{[6-(3-fluorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methyl}piperazine-1-carboxamide

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: 1.696
Molar Refractivity: 114.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.91
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.32
ACD/KOC (pH 5.5): 207.40
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.87
ACD/KOC (pH 7.4): 216.68
Polar Surface Area: 76 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 297.1±7.0 cm3

Click to predict properties on the Chemicalize site


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