ChemSpider 2D Image | 3-({1'-[3-(Dimethylamino)propyl]-1-ethyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrol]-3'-yl}carbonyl)-N,N-dimethylbenzenesulfonamide | C27H32N4O6S

3-({1'-[3-(Dimethylamino)propyl]-1-ethyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrol]-3'-yl}carbonyl)-N,N-dimethylbenzenesulfonamide

  • Molecular FormulaC27H32N4O6S
  • Average mass540.631 Da
  • Monoisotopic mass540.204285 Da
  • ChemSpider ID11913090

More details:

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

3-({1'-[3-(Dimethylamino)propyl]-1-ethyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrol]-3'-yl}carbonyl)-N,N-dimethylbenzenesulfonamide [ACD/IUPAC Name]
3-({1'-[3-(Diméthylamino)propyl]-1-éthyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tétrahydrospiro[indole-3,2'-pyrrol]-3'-yl}carbonyl)-N,N-diméthylbenzènesulfonamide [French] [ACD/IUPAC Name]
3-({1'-[3-(Dimethylamino)propyl]-1-ethyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrol]-3'-yl}carbonyl)-N,N-dimethylbenzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 3-[[1'-[3-(dimethylamino)propyl]-1-ethyl-1,1',2,5'-tetrahydro-4'-hydroxy-2,5'-dioxospiro[3H-indole-3,2'-[2H]pyrrol]-3'-yl]carbonyl]-N,N-dimethyl- [ACD/Index Name]
1-[3-(dimethylamino)propyl]-4-({3-[(dimethylamino)sulfonyl]phenyl}carbonyl)-6-ethyl-3-hydroxyspiro[3-pyrroline-5,3'-indoline]-2,7-dione
3-({1'-[3-(dimethylamino)propyl]-1-ethyl-4'-hydroxy-2,5'-dioxo-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-3'-yl}carbonyl)-N,N-dimethylbenzene-1-sulfonamide
3-(1'-(3-(dimethylamino)propyl)-1-ethyl-4'-hydroxy-2,5'-dioxo-1',5'-dihydrospiro[indoline-3,2'-pyrrol]-3'-ylcarbonyl)-N,N-dimethylbenzenesulfonamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 793.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.0±3.0 kJ/mol
Flash Point: 433.7±35.7 °C
Index of Refraction: 1.670
Molar Refractivity: 142.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.35
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.22
ACD/LogD (pH 7.4): -0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.33
Polar Surface Area: 127 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 381.3±5.0 cm3

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