ChemSpider 2D Image | 5-(4-Phenoxyphenyl)-7-(tetrahydro-2H-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine | C23H22N4O2

5-(4-Phenoxyphenyl)-7-(tetrahydro-2H-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

  • Molecular FormulaC23H22N4O2
  • Average mass386.446 Da
  • Monoisotopic mass386.174286 Da
  • ChemSpider ID11611650

More details:

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

5-(4-Phenoxyphenyl)-7-(tetrahydro-2H-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
5-(4-Phenoxyphenyl)-7-(tetrahydro-2H-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine [ACD/IUPAC Name]
5-(4-Phénoxyphényl)-7-(tétrahydro-2H-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 5-(4-phenoxyphenyl)-7-(tetrahydro-2H-pyran-4-yl)- [ACD/Index Name]
5-(4-Phenoxy-phenyl)-7-(tetrahydro-pyran-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine
CHEMBL296103
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL296103/
VSF

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

Density: 1.3±0.1 g/cm3
Boiling Point: 630.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.4±31.5 °C
Index of Refraction: 1.688
Molar Refractivity: 110.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 305.18
ACD/KOC (pH 5.5): 1557.48
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 839.02
ACD/KOC (pH 7.4): 4281.90
Polar Surface Area: 75 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 290.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement