ChemSpider 2D Image | 2-(7-Methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-N-[2-(trifluoromethyl)phenyl]-1-pyrrolidinecarboxamide | C19H23F3N6O

2-(7-Methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-N-[2-(trifluoromethyl)phenyl]-1-pyrrolidinecarboxamide

  • Molecular FormulaC19H23F3N6O
  • Average mass408.421 Da
  • Monoisotopic mass408.188538 Da
  • ChemSpider ID53597324

More details:

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

1-Pyrrolidinecarboxamide, 2-(6,7,8,9-tetrahydro-7-methyl-5H-1,2,4-triazolo[4,3-d][1,4]diazepin-3-yl)-N-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
2-(7-Methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-N-[2-(trifluormethyl)phenyl]-1-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
2-(7-Methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-N-[2-(trifluoromethyl)phenyl]-1-pyrrolidinecarboxamide [ACD/IUPAC Name]
2-(7-Méthyl-6,7,8,9-tétrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazépin-3-yl)-N-[2-(trifluorométhyl)phényl]-1-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.643
Molar Refractivity: 101.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.42
ACD/LogD (pH 5.5): -0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.38
ACD/KOC (pH 7.4): 21.42
Polar Surface Area: 66 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 281.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement