ChemSpider 2D Image | SSR126768A | C33H31Cl2N3O4

SSR126768A

  • Molecular FormulaC33H31Cl2N3O4
  • Average mass604.523 Da
  • Monoisotopic mass603.169189 Da
  • ChemSpider ID8636683

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Chlor-3-[(3R)-5-chlor-1-(2,4-dimethoxybenzyl)-3-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)benzamid [German] [ACD/IUPAC Name]
4-Chloro-3-[(3R)-5-chloro-1-(2,4-dimethoxybenzyl)-3-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)benzamide [ACD/IUPAC Name]
4-Chloro-3-[(3R)-5-chloro-1-(2,4-diméthoxybenzyl)-3-méthyl-2-oxo-2,3-dihydro-1H-indol-3-yl]-N-éthyl-N-(3-pyridinylméthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-chloro-3-[(3R)-5-chloro-1-[(2,4-dimethoxyphenyl)methyl]-2,3-dihydro-3-methyl-2-oxo-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)- [ACD/Index Name]
SSR126768A
4-chloro-3-[(3R)-5-chloro-1-[(2,4-dimethoxyphenyl)methyl]-3-methyl-2-oxoindol-3-yl]-N-ethyl-N-(pyridin-3-ylmethyl)benzamide
785048-28-4 [RN]
SSR-126768A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 825.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.0±3.0 kJ/mol
Flash Point: 453.3±34.3 °C
Index of Refraction: 1.626
Molar Refractivity: 164.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 5.71
ACD/BCF (pH 5.5): 12395.09
ACD/KOC (pH 5.5): 28354.99
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14416.83
ACD/KOC (pH 7.4): 32979.91
Polar Surface Area: 72 Å2
Polarizability: 65.2±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 464.6±3.0 cm3

Click to predict properties on the Chemicalize site


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