ChemSpider 2D Image | 7-Isobutyl-5-methyl-3-(1-methyl-1H-imidazol-5-yl)-2-(1-naphthylmethyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione | C25H26N6O2

7-Isobutyl-5-methyl-3-(1-methyl-1H-imidazol-5-yl)-2-(1-naphthylmethyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione

  • Molecular FormulaC25H26N6O2
  • Average mass442.513 Da
  • Monoisotopic mass442.211731 Da
  • ChemSpider ID28516468

More details:

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

2H-Pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 5-methyl-3-(1-methyl-1H-imidazol-5-yl)-7-(2-methylpropyl)-2-(1-naphthalenylmethyl)- [ACD/Index Name]
5-Methyl-3-(1-Methyl-1h-Imidazol-5-Yl)-7-(2-Methylpropyl)-2-(Naphthalen-1-Ylmethyl)-2h-Pyrazolo[3,4-D]pyrimidine-4,6(5h,7h)-Dione
7-Isobutyl-5-methyl-3-(1-methyl-1H-imidazol-5-yl)-2-(1-naphthylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4,6(5H,7H)-dion [German] [ACD/IUPAC Name]
7-Isobutyl-5-methyl-3-(1-methyl-1H-imidazol-5-yl)-2-(1-naphthylmethyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione [ACD/IUPAC Name]
7-Isobutyl-5-méthyl-3-(1-méthyl-1H-imidazol-5-yl)-2-(1-naphtylméthyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione [French] [ACD/IUPAC Name]
KRH

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

Density: 1.3±0.1 g/cm3
Boiling Point: 720.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 389.2±35.7 °C
Index of Refraction: 1.687
Molar Refractivity: 127.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 100.01
ACD/KOC (pH 5.5): 708.11
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 265.43
ACD/KOC (pH 7.4): 1879.41
Polar Surface Area: 76 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 335.8±7.0 cm3

Click to predict properties on the Chemicalize site


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