Found 92 results

Search term: MF = 'C_{19}H_{22}FN_{7}O_{2}'
ChemSpider 2D Image | 1-({(2S,4S)-4-Fluoro-1-[(1-methyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide | C19H22FN7O2

1-({(2S,4S)-4-Fluoro-1-[(1-methyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC19H22FN7O2
  • Average mass399.422 Da
  • Monoisotopic mass399.181915 Da
  • ChemSpider ID71076462

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-({(2S,4S)-4-Fluor-1-[(1-methyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl}methyl)-N,N-dimethyl-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1-({(2S,4S)-4-Fluoro-1-[(1-methyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-({(2S,4S)-4-Fluoro-1-[(1-méthyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl}méthyl)-N,N-diméthyl-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxamide, 1-[[(2S,4S)-4-fluoro-1-[(1-methyl-1H-indazol-3-yl)carbonyl]-2-pyrrolidinyl]methyl]-N,N-dimethyl- [ACD/Index Name]
1-({(2S,4S)-4-fluoro-1-[(1-methyl-1H-indazol-3-yl)carbonyl]tetrahydro-1H-pyrrol-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-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: 649.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 346.7±34.3 °C
Index of Refraction: 1.692
Molar Refractivity: 105.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.27
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.88
ACD/LogD (pH 7.4): -0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.88
Polar Surface Area: 89 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 276.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement