ChemSpider 2D Image | 1-Methyl-N-[(3-exo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazole-3-carboxamide | C18H24N4O

1-Methyl-N-[(3-exo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazole-3-carboxamide

  • Molecular FormulaC18H24N4O
  • Average mass312.409 Da
  • Monoisotopic mass312.195007 Da
  • ChemSpider ID24718639
  • 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-methyl-N-[(3-exo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]- [ACD/Index Name]
1-Methyl-N-[(3-exo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
1-Methyl-N-[(3-exo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazole-3-carboxamide [ACD/IUPAC Name]
1-Méthyl-N-[(3-exo)-9-méthyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]
10.1016/j.bmcl.2005.01.008
1364914-39-5 [RN]
Granisetron [Wiki]
Granisetron base
Kytril [Trade name]
Sancuso

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

BRL-43694 [DBID]
LY-278584 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 532.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.8±3.0 kJ/mol
Flash Point: 275.6±27.3 °C
Index of Refraction: 1.690
Molar Refractivity: 89.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.47
ACD/LogD (pH 5.5): -0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 50 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 234.8±7.0 cm3

Click to predict properties on the Chemicalize site






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