ChemSpider 2D Image | N-Ethyl-4-[(5-{[3-(1H-imidazol-1-yl)benzoyl]amino}-2-methylphenyl)amino]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide | C27H26N8O2

N-Ethyl-4-[(5-{[3-(1H-imidazol-1-yl)benzoyl]amino}-2-methylphenyl)amino]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide

  • Molecular FormulaC27H26N8O2
  • Average mass494.548 Da
  • Monoisotopic mass494.217865 Da
  • ChemSpider ID23316681

More details:

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

N-Ethyl-4-[(5-{[3-(1H-imidazol-1-yl)benzoyl]amino}-2-methylphenyl)amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-carboxamid [German] [ACD/IUPAC Name]
N-Ethyl-4-[(5-{[3-(1H-imidazol-1-yl)benzoyl]amino}-2-methylphenyl)amino]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide [ACD/IUPAC Name]
N-Éthyl-4-[(5-{[3-(1H-imidazol-1-yl)benzoyl]amino}-2-méthylphényl)amino]-5-méthylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide [French] [ACD/IUPAC Name]
Pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide, N-ethyl-4-[[5-[[3-(1H-imidazol-1-yl)benzoyl]amino]-2-methylphenyl]amino]-5-methyl- [ACD/Index Name]
4-(5-(3-(1H-imidazol-1-yl)benzamido)-2-methylphenylamino)-N-ethyl-5-methylpyrrolo[1,2-f][1,2,4]triazine-6-carboxamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL262867/

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.701
Molar Refractivity: 141.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 18.72
ACD/KOC (pH 5.5): 246.60
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.29
ACD/KOC (pH 7.4): 399.00
Polar Surface Area: 118 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 55.5±7.0 dyne/cm
Molar Volume: 365.9±7.0 cm3

Click to predict properties on the Chemicalize site


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