ChemSpider 2D Image | (3R,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-N,1''-dimethyl-2-oxo-1,2-dihydrodispiro[indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamide | C24H25Cl2FN4O2

(3R,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-N,1''-dimethyl-2-oxo-1,2-dihydrodispiro[indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamide

  • Molecular FormulaC24H25Cl2FN4O2
  • Average mass491.385 Da
  • Monoisotopic mass490.133850 Da
  • ChemSpider ID58897507

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3R,4'S,5'R)-6-Chlor-4'-(3-chlor-2-fluorphenyl)-N,1''-dimethyl-2-oxo-1,2-dihydrodispiro[indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamid [German] [ACD/IUPAC Name]
(3R,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-N,1''-dimethyl-2-oxo-1,2-dihydrodispiro[indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamide [ACD/IUPAC Name]
(3R,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophényl)-N,1''-diméthyl-2-oxo-1,2-dihydrodispiro[indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamide [French] [ACD/IUPAC Name]
Dispiro[3H-indole-3,3'-pyrrolidine-2',4''-piperidine]-5'-carboxamide, 6-chloro-4'-(3-chloro-2-fluorophenyl)-1,2-dihydro-N,1''-dimethyl-2-oxo-, (3R,4'S,5'R)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 681.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 365.7±31.5 °C
Index of Refraction: 1.661
Molar Refractivity: 125.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.79
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 1.51
ACD/KOC (pH 7.4): 8.52
Polar Surface Area: 73 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 339.9±5.0 cm3

Click to predict properties on the Chemicalize site


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