ChemSpider 2D Image | 6-Ethyl-5-methyl-N~4~-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-pyrimidinediamine | C13H19N5S

6-Ethyl-5-methyl-N4-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-pyrimidinediamine

  • Molecular FormulaC13H19N5S
  • Average mass277.388 Da
  • Monoisotopic mass277.136108 Da
  • ChemSpider ID29515637

More details:

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

2,4-Pyrimidinediamine, 6-ethyl-5-methyl-N4-[1-(2-methyl-4-thiazolyl)ethyl]- [ACD/Index Name]
6-Ethyl-5-methyl-N4-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
6-Ethyl-5-methyl-N4-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-pyrimidinediamine [ACD/IUPAC Name]
6-Éthyl-5-méthyl-N4-[1-(2-méthyl-1,3-thiazol-4-yl)éthyl]-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]
6-ethyl-5-methyl-N4-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-diamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 495.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 253.2±31.5 °C
Index of Refraction: 1.645
Molar Refractivity: 81.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.93
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 11.44
ACD/KOC (pH 7.4): 126.04
Polar Surface Area: 105 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 223.6±3.0 cm3

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