Found 756 results

Search term: MF = 'C_{23}H_{31}N_{7}O'
ChemSpider 2D Image | 1-(2-{[6-Cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-(2-methyl-2-propanyl)urea | C23H31N7O

1-(2-{[6-Cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-(2-methyl-2-propanyl)urea

  • Molecular FormulaC23H31N7O
  • Average mass421.539 Da
  • Monoisotopic mass421.259003 Da
  • ChemSpider ID22685625

More details:

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

1-(2-{[6-Cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-(2-methyl-2-propanyl)harnstoff [German] [ACD/IUPAC Name]
1-(2-{[6-Cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-(2-methyl-2-propanyl)urea [ACD/IUPAC Name]
1-(2-{[6-Cyclopropyl-3-méthyl-1-(4-méthylphényl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}éthyl)-3-(2-méthyl-2-propanyl)urée [French] [ACD/IUPAC Name]
Urea, N-[2-[[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl]-N'-(1,1-dimethylethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 580.4±50.0 °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: 304.8±30.1 °C
Index of Refraction: 1.666
Molar Refractivity: 121.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 476.47
ACD/KOC (pH 5.5): 2810.83
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 514.92
ACD/KOC (pH 7.4): 3037.65
Polar Surface Area: 97 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 325.9±7.0 cm3

Click to predict properties on the Chemicalize site


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