ChemSpider 2D Image | N-[2-Methyl-5-(1-piperidinylmethyl)phenyl]-4-{[4-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino}benzamide | C30H32N8O

N-[2-Methyl-5-(1-piperidinylmethyl)phenyl]-4-{[4-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino}benzamide

  • Molecular FormulaC30H32N8O
  • Average mass520.628 Da
  • Monoisotopic mass520.269897 Da
  • ChemSpider ID31137994

More details:

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

Benzamide, N-[2-methyl-5-(1-piperidinylmethyl)phenyl]-4-[[4-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino]- [ACD/Index Name]
N-[2-Methyl-5-(1-piperidinylmethyl)phenyl]-4-{[4-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino}benzamid [German] [ACD/IUPAC Name]
N-[2-Methyl-5-(1-piperidinylmethyl)phenyl]-4-{[4-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino}benzamide [ACD/IUPAC Name]
N-[2-Méthyl-5-(1-pipéridinylméthyl)phényl]-4-{[4-(1-méthyl-1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino}benzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.702
Molar Refractivity: 153.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.53
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 8.71
ACD/KOC (pH 7.4): 57.67
Polar Surface Area: 92 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 54.9±7.0 dyne/cm
Molar Volume: 395.2±7.0 cm3

Click to predict properties on the Chemicalize site


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