ChemSpider 2D Image | 1-Isopropyl-N-[(3-endo)-8-{2-[4-(methylsulfonyl)-1-piperazinyl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl]-1H-indazole-3-carboxamide | C25H38N6O3S

1-Isopropyl-N-[(3-endo)-8-{2-[4-(methylsulfonyl)-1-piperazinyl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl]-1H-indazole-3-carboxamide

  • Molecular FormulaC25H38N6O3S
  • Average mass502.673 Da
  • Monoisotopic mass502.272614 Da
  • ChemSpider ID28515642

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1H-Indazole-3-carboxamide, 1-(1-methylethyl)-N-[(3-endo)-8-[2-[4-(methylsulfonyl)-1-piperazinyl]ethyl]-8-azabicyclo[3.2.1]oct-3-yl]- [ACD/Index Name]
1-Isopropyl-N-[(3-endo)-8-{2-[4-(methylsulfonyl)-1-piperazinyl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl]-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
1-Isopropyl-N-[(3-endo)-8-{2-[4-(methylsulfonyl)-1-piperazinyl]ethyl}-8-azabicyclo[3.2.1]oct-3-yl]-1H-indazole-3-carboxamide [ACD/IUPAC Name]
1-Isopropyl-N-[(3-endo)-8-{2-[4-(méthylsulfonyl)-1-pipérazinyl]éthyl}-8-azabicyclo[3.2.1]oct-3-yl]-1H-indazole-3-carboxamide [French] [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: 1.687
Molar Refractivity: 137.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.60
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 359.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement