ChemSpider 2D Image | 5-[(1E,3R)-2-(2-Methoxyphenyl)-3-methyl-1-penten-1-yl]furo[2,3-d]pyrimidine-2,4-diamine | C19H22N4O2

5-[(1E,3R)-2-(2-Methoxyphenyl)-3-methyl-1-penten-1-yl]furo[2,3-d]pyrimidine-2,4-diamine

  • Molecular FormulaC19H22N4O2
  • Average mass338.404 Da
  • Monoisotopic mass338.174286 Da
  • ChemSpider ID25058903
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

5-[(1E,3R)-2-(2-Methoxyphenyl)-3-methyl-1-penten-1-yl]furo[2,3-d]pyrimidin-2,4-diamin [German] [ACD/IUPAC Name]
5-[(1E,3R)-2-(2-Methoxyphenyl)-3-methyl-1-penten-1-yl]furo[2,3-d]pyrimidine-2,4-diamine [ACD/IUPAC Name]
5-[(1E,3R)-2-(2-Méthoxyphényl)-3-méthyl-1-pentén-1-yl]furo[2,3-d]pyrimidine-2,4-diamine [French] [ACD/IUPAC Name]
5-[(1e,3r)-2-(2-Methoxyphenyl)-3-Methylpent-1-En-1-Yl]furo[2,3-D]pyrimidine-2,4-Diamine
Furo[2,3-d]pyrimidine-2,4-diamine, 5-[(1E,3R)-2-(2-methoxyphenyl)-3-methyl-1-penten-1-yl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 549.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 286.3±32.9 °C
Index of Refraction: 1.668
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 21.42
ACD/KOC (pH 5.5): 133.96
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 336.06
ACD/KOC (pH 7.4): 2101.93
Polar Surface Area: 100 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 274.3±3.0 cm3

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