ChemSpider 2D Image | N~1~-[2-(1H-Indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methyl-1,2-propanediamine | C18H19N7

N1-[2-(1H-Indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methyl-1,2-propanediamine

  • Molecular FormulaC18H19N7
  • Average mass333.390 Da
  • Monoisotopic mass333.170197 Da
  • ChemSpider ID35035173

More details:

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

1,2-Propanediamine, N1-[2-(1H-indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methyl- [ACD/Index Name]
N1-[2-(1H-Indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methyl-1,2-propandiamin [German] [ACD/IUPAC Name]
N1-[2-(1H-Indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methyl-1,2-propanediamine [ACD/IUPAC Name]
N1-[2-(1H-Indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-méthyl-1,2-propanediamine [French] [ACD/IUPAC Name]
N1-[2-(1h-Indazol-5-Yl)pyrido[3,4-D]pyrimidin-4-Yl]-2-Methylpropane-1,2-Diamine
3J7
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3338838/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 537.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.6±30.1 °C
Index of Refraction: 1.748
Molar Refractivity: 100.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 1.11
ACD/KOC (pH 7.4): 15.86
Polar Surface Area: 105 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 246.9±3.0 cm3

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