Found 830 results

Search term: MF = 'C_{21}H_{31}N_{5}O_{3}S'
ChemSpider 2D Image | Ethyl 4-{[6-(1-azocanylcarbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl}-1-piperazinecarboxylate | C21H31N5O3S

Ethyl 4-{[6-(1-azocanylcarbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl}-1-piperazinecarboxylate

  • Molecular FormulaC21H31N5O3S
  • Average mass433.568 Da
  • Monoisotopic mass433.214752 Da
  • ChemSpider ID22195999

More details:

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

1-Piperazinecarboxylic acid, 4-[[6-[(hexahydro-1(2H)-azocinyl)carbonyl]imidazo[2,1-b]thiazol-5-yl]methyl]-, ethyl ester [ACD/Index Name]
4-{[6-(1-Azocanylcarbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]méthyl}-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-{[6-(1-azocanylcarbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl}-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-{[6-(1-azocanylcarbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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: 1.667
Molar Refractivity: 118.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 16.93
ACD/KOC (pH 5.5): 179.59
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 63.17
ACD/KOC (pH 7.4): 669.96
Polar Surface Area: 99 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 56.6±7.0 dyne/cm
Molar Volume: 319.0±7.0 cm3

Click to predict properties on the Chemicalize site


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