ChemSpider 2D Image | 2-Methyl-2-propanyl 4-(5-bromo-7-carbamoyl-1H-indazol-3-yl)-1-piperidinecarboxylate | C18H23BrN4O3

2-Methyl-2-propanyl 4-(5-bromo-7-carbamoyl-1H-indazol-3-yl)-1-piperidinecarboxylate

  • Molecular FormulaC18H23BrN4O3
  • Average mass423.304 Da
  • Monoisotopic mass422.095337 Da
  • ChemSpider ID30913447

More details:

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

1-Piperidinecarboxylic acid, 4-[7-(aminocarbonyl)-5-bromo-1H-indazol-3-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(5-bromo-7-carbamoyl-1H-indazol-3-yl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(5-brom-7-carbamoyl-1H-indazol-3-yl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-(5-Bromo-7-carbamoyl-1H-indazol-3-yl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
872350-15-7 [RN]
1-piperidinecarboxylic acid,4-[7-(aminocarbonyl)-5-bromo-1h-indazol-3-yl]-,1,1-dimethylethyl ester
tert-butyl 4-(5-bromo-7-carbamoyl-1H-indazol-3-yl)piperidine-1-carboxylate
tert-Butyl 4-(5-bromo-7-carbamoyl-2H-indazol-3-yl)piperidine-1-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 595.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.0±30.1 °C
Index of Refraction: 1.629
Molar Refractivity: 102.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 115.10
ACD/KOC (pH 5.5): 1039.75
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 115.08
ACD/KOC (pH 7.4): 1039.54
Polar Surface Area: 101 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 289.4±3.0 cm3

Click to predict properties on the Chemicalize site


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