ChemSpider 2D Image | N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluorobenzyl)(~2~H_4_)-1H-indazole-3-carboxamide | C20H17D4FN4O2

N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluorobenzyl)(2H4)-1H-indazole-3-carboxamide

  • Molecular FormulaC20H17D4FN4O2
  • Average mass372.429 Da
  • Monoisotopic mass372.189972 Da
  • ChemSpider ID30922475
  • Non-standard isotope - Non-standard isotope


More details:






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

1H-Indazole-4,5,6,7-d4-3-carboxamide, N-[1-(aminocarbonyl)-2-methylpropyl]-1-[(4-fluorophenyl)methyl]- [ACD/Index Name]
N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluorbenzyl)(2H4)-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluorobenzyl)(2H4)-1H-indazole-3-carboxamide [ACD/IUPAC Name]
N-(1-Amino-3-méthyl-1-oxo-2-butanyl)-1-(4-fluorobenzyl)(2H4)-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]
AB-FUBINACA-d4
AB-FUBINACA-d4 (exempt preparation)
N-[(1S)-1-(aminocarbonyl)-2-methylpropyl]-1-[(4-fluorophenyl)methyl]-4,5,6,7-d4-1H-indazole-3-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 659.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.0±3.0 kJ/mol
Flash Point: 352.5±30.1 °C
Index of Refraction: 1.630
Molar Refractivity: 100.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 34.37
ACD/KOC (pH 5.5): 437.72
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 34.34
ACD/KOC (pH 7.4): 437.35
Polar Surface Area: 90 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 281.6±7.0 cm3

Click to predict properties on the Chemicalize site






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