ChemSpider 2D Image | 2-({5-[4-(1,3-Benzodioxol-5-ylcarbonyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-isopropylacetamide | C19H23N5O4S2

2-({5-[4-(1,3-Benzodioxol-5-ylcarbonyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-isopropylacetamide

  • Molecular FormulaC19H23N5O4S2
  • Average mass449.547 Da
  • Monoisotopic mass449.119141 Da
  • ChemSpider ID22540866

More details:

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

2-({5-[4-(1,3-Benzodioxol-5-ylcarbonyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-isopropylacetamid [German] [ACD/IUPAC Name]
2-({5-[4-(1,3-Benzodioxol-5-ylcarbonyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-isopropylacetamide [ACD/IUPAC Name]
2-({5-[4-(1,3-Benzodioxol-5-ylcarbonyl)-1-pipérazinyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-isopropylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[5-[4-(1,3-benzodioxol-5-ylcarbonyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl]thio]-N-(1-methylethyl)- [ACD/Index Name]
1105226-76-3 [RN]
2-((5-(4-(benzo[d][1,3]dioxole-5-carbonyl)piperazin-1-yl)-1,3,4-thiadiazol-2-yl)thio)-N-isopropylacetamide
2-({5-[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(propan-2-yl)acetamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.672
Molar Refractivity: 115.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.61
ACD/KOC (pH 5.5): 68.81
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.65
ACD/KOC (pH 7.4): 69.87
Polar Surface Area: 150 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 77.5±5.0 dyne/cm
Molar Volume: 307.4±5.0 cm3

Click to predict properties on the Chemicalize site


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