ChemSpider 2D Image | 3,4,5-Trimethoxy-N-(3-{[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl}propyl)benzamide | C21H29N5O6S

3,4,5-Trimethoxy-N-(3-{[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl}propyl)benzamide

  • Molecular FormulaC21H29N5O6S
  • Average mass479.550 Da
  • Monoisotopic mass479.183868 Da
  • ChemSpider ID21926181

More details:

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

3,4,5-Trimethoxy-N-(3-{[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl}propyl)benzamid [German] [ACD/IUPAC Name]
3,4,5-Trimethoxy-N-(3-{[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl}propyl)benzamide [ACD/IUPAC Name]
3,4,5-Triméthoxy-N-(3-{[4-(2-pyrimidinyl)-1-pipérazinyl]sulfonyl}propyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,4,5-trimethoxy-N-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propyl]- [ACD/Index Name]
1021221-45-3 [RN]
3,4,5-trimethoxy-N-(3-((4-(pyrimidin-2-yl)piperazin-1-yl)sulfonyl)propyl)benzamide
3,4,5-trimethoxy-N-(3-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}propyl)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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.612
Molar Refractivity: 121.5±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.77
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.88
ACD/KOC (pH 5.5): 51.59
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 2.32
ACD/KOC (pH 7.4): 63.54
Polar Surface Area: 132 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 67.3±5.0 dyne/cm
Molar Volume: 349.6±5.0 cm3

Click to predict properties on the Chemicalize site


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