ChemSpider 2D Image | N-Cyclohexyl-5-{1-[(5-isoquinolinylmethyl)amino]ethyl}-N,4-dimethyl-2-pyrimidinamine | C24H31N5

N-Cyclohexyl-5-{1-[(5-isoquinolinylmethyl)amino]ethyl}-N,4-dimethyl-2-pyrimidinamine

  • Molecular FormulaC24H31N5
  • Average mass389.536 Da
  • Monoisotopic mass389.257935 Da
  • ChemSpider ID22157883

More details:

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

5-Isoquinolinemethanamine, N-[1-[2-(cyclohexylmethylamino)-4-methyl-5-pyrimidinyl]ethyl]- [ACD/Index Name]
N-Cyclohexyl-5-{1-[(5-isochinolinylmethyl)amino]ethyl}-N,4-dimethyl-2-pyrimidinamin [German] [ACD/IUPAC Name]
N-Cyclohexyl-5-{1-[(5-isoquinoléinylméthyl)amino]éthyl}-N,4-diméthyl-2-pyrimidinamine [French] [ACD/IUPAC Name]
N-Cyclohexyl-5-{1-[(5-isoquinolinylmethyl)amino]ethyl}-N,4-dimethyl-2-pyrimidinamine [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 580.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.6±32.9 °C
Index of Refraction: 1.630
Molar Refractivity: 120.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 224.39
ACD/KOC (pH 5.5): 837.30
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2317.20
ACD/KOC (pH 7.4): 8646.50
Polar Surface Area: 54 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 339.6±3.0 cm3

Click to predict properties on the Chemicalize site


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