ChemSpider 2D Image | (2S)-6-Fluoro-5-[3-(8-fluoro-1-methyl-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-2-methylphenyl]-2-(2-hydroxy-2-propanyl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide | C32H30F2N4O4

(2S)-6-Fluoro-5-[3-(8-fluoro-1-methyl-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-2-methylphenyl]-2-(2-hydroxy-2-propanyl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide

  • Molecular FormulaC32H30F2N4O4
  • Average mass572.602 Da
  • Monoisotopic mass572.223511 Da
  • ChemSpider ID59053540
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-6-Fluor-5-[3-(8-fluor-1-methyl-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl)-2-methylphenyl]-2-(2-hydroxy-2-propanyl)-2,3,4,9-tetrahydro-1H-carbazol-8-carboxamid [German] [ACD/IUPAC Name]
(2S)-6-Fluoro-5-[3-(8-fluoro-1-methyl-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-2-methylphenyl]-2-(2-hydroxy-2-propanyl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide [ACD/IUPAC Name]
(2S)-6-Fluoro-5-[3-(8-fluoro-1-méthyl-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-2-méthylphényl]-2-(2-hydroxy-2-propanyl)-2,3,4,9-tétrahydro-1H-carbazole-8-carboxamide [French] [ACD/IUPAC Name]
1643368-58-4 [RN]
1H-Carbazole-8-carboxamide, 6-fluoro-5-[3-(8-fluoro-1,4-dihydro-1-methyl-2,4-dioxo-3(2H)-quinazolinyl)-2-methylphenyl]-2,3,4,9-tetrahydro-2-(1-hydroxy-1-methylethyl)-, (2S)- [ACD/Index Name]
6-Fluoro-5-(R)-(3-(S)-(8-Fluoro-1-Methyl-2,4-Dioxo-1,2-Dihydroquinazolin-3(4h)-Yl)-2-Methylphenyl)-2-(S)-(2-Hydroxypropan-2-Yl)-2,3,4,9-Tetrahydro-1h-Carbazole-8-Carboxamide
73T
Bms-986142

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

PJX9GH268R [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 746.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.2±3.0 kJ/mol
Flash Point: 405.3±35.7 °C
Index of Refraction: 1.667
Molar Refractivity: 152.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1498.83
ACD/KOC (pH 5.5): 6528.32
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 1498.83
ACD/KOC (pH 7.4): 6528.32
Polar Surface Area: 120 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 410.8±3.0 cm3

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