ChemSpider 2D Image | N-[6-(Cyclopropylmethoxy)-2-(6-isobutyl-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1H)-yl)-7-methoxy-4-quinazolinyl]-2,2,2-trifluoroethanesulfonamide | C27H32F3N5O5S

N-[6-(Cyclopropylmethoxy)-2-(6-isobutyl-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1H)-yl)-7-methoxy-4-quinazolinyl]-2,2,2-trifluoroethanesulfonamide

  • Molecular FormulaC27H32F3N5O5S
  • Average mass595.634 Da
  • Monoisotopic mass595.207642 Da
  • ChemSpider ID25058969

More details:

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

Ethanesulfonamide, N-[6-(cyclopropylmethoxy)-7-methoxy-2-[3,4,5,6-tetrahydro-6-(2-methylpropyl)-5-oxo-2,6-naphthyridin-2(1H)-yl]-4-quinazolinyl]-2,2,2-trifluoro- [ACD/Index Name]
N-[6-(Cyclopropylmethoxy)-2-(6-isobutyl-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1H)-yl)-7-methoxy-4-chinazolinyl]-2,2,2-trifluorethansulfonamid [German] [ACD/IUPAC Name]
N-[6-(Cyclopropylmethoxy)-2-(6-isobutyl-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1H)-yl)-7-methoxy-4-quinazolinyl]-2,2,2-trifluoroethanesulfonamide [ACD/IUPAC Name]
N-[6-(Cyclopropylméthoxy)-2-(6-isobutyl-5-oxo-3,4,5,6-tétrahydro-2,6-naphtyridin-2(1H)-yl)-7-méthoxy-4-quinazolinyl]-2,2,2-trifluoroéthanesulfonamide [French] [ACD/IUPAC Name]
N-{6-(Cyclopropylmethoxy)-7-Methoxy-2-[6-(2-Methylpropyl)-5-Oxo-3,4,5,6-Tetrahydro-2,6-Naphthyridin-2(1h)-Yl]quinazolin-4-Yl}-2,2,2-Trifluoroethanesulfonamide
LZS

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

Density: 1.4±0.1 g/cm3
Boiling Point: 771.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.3±35.7 °C
Index of Refraction: 1.624
Molar Refractivity: 145.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 3.84
ACD/KOC (pH 5.5): 24.64
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 3.85
ACD/KOC (pH 7.4): 24.67
Polar Surface Area: 122 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 63.3±5.0 dyne/cm
Molar Volume: 411.6±5.0 cm3

Click to predict properties on the Chemicalize site


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