ChemSpider 2D Image | 6-Amino-2,5-dimethyl-N-{1-[5-(trifluoromethyl)-2-pyrimidinyl]-3-azetidinyl}thieno[3,2-e][1,2,4]triazolo[1,5-a]pyridine-7-carboxamide | C19H17F3N8OS

6-Amino-2,5-dimethyl-N-{1-[5-(trifluoromethyl)-2-pyrimidinyl]-3-azetidinyl}thieno[3,2-e][1,2,4]triazolo[1,5-a]pyridine-7-carboxamide

  • Molecular FormulaC19H17F3N8OS
  • Average mass462.452 Da
  • Monoisotopic mass462.119812 Da
  • ChemSpider ID128722529

More details:

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

6-Amino-2,5-dimethyl-N-{1-[5-(trifluormethyl)-2-pyrimidinyl]-3-azetidinyl}thieno[3,2-e][1,2,4]triazolo[1,5-a]pyridin-7-carboxamid [German] [ACD/IUPAC Name]
6-Amino-2,5-dimethyl-N-{1-[5-(trifluoromethyl)-2-pyrimidinyl]-3-azetidinyl}thieno[3,2-e][1,2,4]triazolo[1,5-a]pyridine-7-carboxamide [ACD/IUPAC Name]
6-Amino-2,5-diméthyl-N-{1-[5-(trifluorométhyl)-2-pyrimidinyl]-3-azétidinyl}thiéno[3,2-e][1,2,4]triazolo[1,5-a]pyridine-7-carboxamide [French] [ACD/IUPAC Name]
Thieno[3,2-e][1,2,4]triazolo[1,5-a]pyridine-7-carboxamide, 6-amino-2,5-dimethyl-N-[1-[5-(trifluoromethyl)-2-pyrimidinyl]-3-azetidinyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4533701/

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.791
Molar Refractivity: 110.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 106.93
ACD/KOC (pH 5.5): 980.32
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 109.17
ACD/KOC (pH 7.4): 1000.90
Polar Surface Area: 143 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 65.3±7.0 dyne/cm
Molar Volume: 261.6±7.0 cm3

Click to predict properties on the Chemicalize site


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