ChemSpider 2D Image | 5-Methyl-2-(3-{[4-(1-pyrrolidinylmethyl)-1,2,3-triazolidin-1-yl]methyl}-1-piperidinyl)-4-pyrimidinamine | C18H32N8

5-Methyl-2-(3-{[4-(1-pyrrolidinylmethyl)-1,2,3-triazolidin-1-yl]methyl}-1-piperidinyl)-4-pyrimidinamine

  • Molecular FormulaC18H32N8
  • Average mass360.500 Da
  • Monoisotopic mass360.274994 Da
  • ChemSpider ID110187910

More details:

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

4-Pyrimidinamine, 5-methyl-2-[3-[[4-(1-pyrrolidinylmethyl)-1,2,3-triazolidin-1-yl]methyl]-1-piperidinyl]- [ACD/Index Name]
5-Methyl-2-(3-{[4-(1-pyrrolidinylmethyl)-1,2,3-triazolidin-1-yl]methyl}-1-piperidinyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
5-Methyl-2-(3-{[4-(1-pyrrolidinylmethyl)-1,2,3-triazolidin-1-yl]methyl}-1-piperidinyl)-4-pyrimidinamine [ACD/IUPAC Name]
5-Méthyl-2-(3-{[4-(1-pyrrolidinylméthyl)-1,2,3-triazolidin-1-yl]méthyl}-1-pipéridinyl)-4-pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 560.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.3±3.0 kJ/mol
Flash Point: 292.9±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 103.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): -3.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 86 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 305.6±3.0 cm3

Click to predict properties on the Chemicalize site


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