ChemSpider 2D Image | 2-Amino-4-{2,4-dichloro-6-[2-(1H-pyrazol-1-yl)ethoxy]phenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide | C21H21Cl2F2N7O2

2-Amino-4-{2,4-dichloro-6-[2-(1H-pyrazol-1-yl)ethoxy]phenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide

  • Molecular FormulaC21H21Cl2F2N7O2
  • Average mass512.340 Da
  • Monoisotopic mass511.110199 Da
  • ChemSpider ID26326896

More details:

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

2-Amino-4-{2,4-dichlor-6-[2-(1H-pyrazol-1-yl)ethoxy]phenyl}-N-(2,2-difluorpropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidin-6-carboxamid [German] [ACD/IUPAC Name]
2-Amino-4-{2,4-dichloro-6-[2-(1H-pyrazol-1-yl)ethoxy]phenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide [ACD/IUPAC Name]
2-Amino-4-{2,4-dichloro-6-[2-(1H-pyrazol-1-yl)éthoxy]phényl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide [French] [ACD/IUPAC Name]
6H-Pyrrolo[3,4-d]pyrimidine-6-carboxamide, 2-amino-4-[2,4-dichloro-6-[2-(1H-pyrazol-1-yl)ethoxy]phenyl]-N-(2,2-difluoropropyl)-5,7-dihydro- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 122.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 258.23
ACD/KOC (pH 5.5): 1852.99
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 258.72
ACD/KOC (pH 7.4): 1856.50
Polar Surface Area: 111 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 326.1±7.0 cm3

Click to predict properties on the Chemicalize site


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