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Search term: YIPMRGBQLTUOEL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N'-[(2-{1-[2-(2-Chlorophenoxy)-2-methylpropanoyl]-4-piperidinyl}-1,3-thiazol-4-yl)carbonyl]-1,4-dimethyl-2-piperazinecarbohydrazide | C26H35ClN6O4S

N'-[(2-{1-[2-(2-Chlorophenoxy)-2-methylpropanoyl]-4-piperidinyl}-1,3-thiazol-4-yl)carbonyl]-1,4-dimethyl-2-piperazinecarbohydrazide

  • Molecular FormulaC26H35ClN6O4S
  • Average mass563.112 Da
  • Monoisotopic mass562.212891 Da
  • ChemSpider ID2610528

More details:

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

2-Piperazinecarboxylic acid, 1,4-dimethyl-, 2-[[2-[1-[2-(2-chlorophenoxy)-2-methyl-1-oxopropyl]-4-piperidinyl]-4-thiazolyl]carbonyl]hydrazide [ACD/Index Name]
N'-[(2-{1-[2-(2-Chlorophenoxy)-2-methylpropanoyl]-4-piperidinyl}-1,3-thiazol-4-yl)carbonyl]-1,4-dimethyl-2-piperazinecarbohydrazide [ACD/IUPAC Name]
N'-[(2-{1-[2-(2-Chlorophénoxy)-2-méthylpropanoyl]-4-pipéridinyl}-1,3-thiazol-4-yl)carbonyl]-1,4-diméthyl-2-pipérazinecarbohydrazide [French] [ACD/IUPAC Name]
N'-[(2-{1-[2-(2-Chlorphenoxy)-2-methylpropanoyl]-4-piperidinyl}-1,3-thiazol-4-yl)carbonyl]-1,4-dimethyl-2-piperazincarbohydrazid [German] [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: 784.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 428.0±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 147.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.48
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.12
ACD/KOC (pH 7.4): 108.22
Polar Surface Area: 135 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 436.5±3.0 cm3

Click to predict properties on the Chemicalize site


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