ChemSpider 2D Image | 4-(2,3-Dihydro-1H-indol-1-ylsulfonyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide | C29H24N4O3S2

4-(2,3-Dihydro-1H-indol-1-ylsulfonyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide

  • Molecular FormulaC29H24N4O3S2
  • Average mass540.656 Da
  • Monoisotopic mass540.128967 Da
  • ChemSpider ID20843308

More details:

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

4-(2,3-Dihydro-1H-indol-1-ylsulfonyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamid [German] [ACD/IUPAC Name]
4-(2,3-Dihydro-1H-indol-1-ylsulfonyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide [ACD/IUPAC Name]
4-(2,3-Dihydro-1H-indol-1-ylsulfonyl)-N-(4-méthyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylméthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-N-(4-methyl-2-benzothiazolyl)-N-(3-pyridinylmethyl)- [ACD/Index Name]
4-(indolin-1-ylsulfonyl)-N-(4-methylbenzo[d]thiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 745.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.6±3.0 kJ/mol
Flash Point: 404.4±35.7 °C
Index of Refraction: 1.716
Molar Refractivity: 150.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2332.51
ACD/KOC (pH 5.5): 8831.91
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2451.66
ACD/KOC (pH 7.4): 9283.06
Polar Surface Area: 120 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 71.6±3.0 dyne/cm
Molar Volume: 381.3±3.0 cm3

Click to predict properties on the Chemicalize site


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