Found 1 result

Search term: RPNUUULYRBUSBJ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 1-{4-[(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]-2-pyridinyl}-3-(2,4-difluorophenyl)urea | C22H19F2N7O2

1-{4-[(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]-2-pyridinyl}-3-(2,4-difluorophenyl)urea

  • Molecular FormulaC22H19F2N7O2
  • Average mass451.429 Da
  • Monoisotopic mass451.156830 Da
  • ChemSpider ID59052240

More details:

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

1-{4-[(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]-2-pyridinyl}-3-(2,4-difluorophenyl)urea [ACD/IUPAC Name]
1-{4-[(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]-2-pyridinyl}-3-(2,4-difluorophényl)urée [French] [ACD/IUPAC Name]
1-{4-[(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]-2-pyridinyl}-3-(2,4-difluorphenyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-[4-[[4-amino-7-(1-methylethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]carbonyl]-2-pyridinyl]-N'-(2,4-difluorophenyl)- [ACD/Index Name]
6K0
N-{4-[4-Amino-7-(Propan-2-Yl)-7h-Pyrrolo[2,3-D]pyrimidine-5-Carbonyl]pyridin-2-Yl}-N'-(2,4-Difluorophenyl)urea

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

Density: 1.5±0.1 g/cm3
Boiling Point: 586.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.5±30.1 °C
Index of Refraction: 1.694
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.36
ACD/KOC (pH 5.5): 582.15
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.36
ACD/KOC (pH 7.4): 615.51
Polar Surface Area: 128 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 54.7±7.0 dyne/cm
Molar Volume: 302.1±7.0 cm3

Click to predict properties on the Chemicalize site


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