ChemSpider 2D Image | Giripladib | C41H36ClF3N2O4S

Giripladib

  • Molecular FormulaC41H36ClF3N2O4S
  • Average mass745.249 Da
  • Monoisotopic mass744.203613 Da
  • ChemSpider ID9896558

More details:

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

1W10Q5H7WD
4-(3-{5-Chlor-1-(diphenylmethyl)-2-[2-({[2-(trifluormethyl)benzyl]sulfonyl}amino)ethyl]-1H-indol-3-yl}propyl)benzoesäure [German] [ACD/IUPAC Name]
4-(3-{5-Chloro-1-(diphenylmethyl)-2-[2-({[2-(trifluoromethyl)benzyl]sulfonyl}amino)ethyl]-1H-indol-3-yl}propyl)benzoic acid [ACD/IUPAC Name]
865200-20-0 [RN]
Acide 4-(3-{5-chloro-1-(diphénylméthyl)-2-[2-({[2-(trifluorométhyl)benzyl]sulfonyl}amino)éthyl]-1H-indol-3-yl}propyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-[5-chloro-1-(diphenylmethyl)-2-[2-[[[[2-(trifluoromethyl)phenyl]methyl]sulfonyl]amino]ethyl]-1H-indol-3-yl]propyl]- [ACD/Index Name]
Giripladib [USAN]
4-(3-(5-chloro-1-(diphenylmethyl)-2-(2-(((2-(trifluoromethyl)benzyl)sulfonyl)amino)ethyl)-1h-indole-3-yl)propyl)benzoic acid
4-[3-[1-benzhydryl-5-chloro-2-[2-[[2-(trifluoromethyl)phenyl]methylsulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid
4-[3-[5-chloro-1-[di(phenyl)methyl]-2-[2-[[2-(trifluoromethyl)benzyl]sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid
More...

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

8810 [DBID]
PLA-695 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 852.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 129.8±3.0 kJ/mol
Flash Point: 469.4±37.1 °C
Index of Refraction: 1.612
Molar Refractivity: 199.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 10.50
ACD/LogD (pH 5.5): 8.78
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 411043.50
ACD/LogD (pH 7.4): 7.16
ACD/BCF (pH 7.4): 34743.88
ACD/KOC (pH 7.4): 9902.27
Polar Surface Area: 97 Å2
Polarizability: 79.1±0.5 10-24cm3
Surface Tension: 46.7±7.0 dyne/cm
Molar Volume: 573.5±7.0 cm3

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