ChemSpider 2D Image | 2-[4-(4-{(Z)-[3-(3-Fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoyl)-1-piperazinyl]-N-isopropylacetamide | C27H29FN4O4S

2-[4-(4-{(Z)-[3-(3-Fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoyl)-1-piperazinyl]-N-isopropylacetamide

  • Molecular FormulaC27H29FN4O4S
  • Average mass524.607 Da
  • Monoisotopic mass524.189331 Da
  • ChemSpider ID22839268

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Piperazineacetamide, 4-[4-[(Z)-[3-[(3-fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]benzoyl]-N-(1-methylethyl)- [ACD/Index Name]
2-[4-(4-{(Z)-[3-(3-Fluorbenzyl)-2,4-dioxo-1,3-thiazolidin-5-yliden]methyl}benzoyl)-1-piperazinyl]-N-isopropylacetamid [German] [ACD/IUPAC Name]
2-[4-(4-{(Z)-[3-(3-Fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoyl)-1-piperazinyl]-N-isopropylacetamide [ACD/IUPAC Name]
2-[4-(4-{(Z)-[3-(3-Fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidène]méthyl}benzoyl)-1-pipérazinyl]-N-isopropylacétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.641
Molar Refractivity: 141.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 47.78
ACD/KOC (pH 5.5): 544.35
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.85
ACD/KOC (pH 7.4): 579.26
Polar Surface Area: 115 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 392.1±3.0 cm3

Click to predict properties on the Chemicalize site


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